[3] 5-'GH'-3-((4-'GH'piperazin-1-yl)methyl)-1H-indole

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Citations (129)

Structure/Compound Data Chemical Name: N-piperazinyl-3-indolylmethylamine Reaxys Registry Number: 9130285

Type of Substance: heterocyclic Molecular Formula: C13H17N3

Linear Structure Formula: C13H17N3

Molecular Weight: 215.298

InChI Key: ZTNAIHGOFCMOPJ-UHFFFAOYSA-N

N° of preparations All Preps | All Reactions

Available Data

5 prep out of 6 reactions.

5 prep out of 29 reactions.

Target

N° of ref.

Druglikeness

Bioactivity

Identification Physical Data (2) Spectra (1)

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4

Druglikeness

Bioactivity

Identification Physical Data (4) Spectra (7)

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8

1

Synthesize | Show Details Find similar Chemical Name: 3-[(4-methyl-1-piperazinyl)methyl]-1H-indole Reaxys Registry Number: 885083

CAS Registry Number: 5444-91-7 Type of Substance: heterocyclic Molecular Formula: C14H19N3

Linear Structure Formula: C14H19N3

Molecular Weight: 229.325

InChI Key: YLWXBMKGZWALKM-UHFFFAOYSA-N

2

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Chemical Name: 4-indol-3-ylmethyl-piperazin-1-ylamine Reaxys Registry Number: 616281

CAS Registry Number: 58433-77-5 Type of Substance: heterocyclic Molecular Formula: C13H18N4

Linear Structure Formula: C13H18N4

Molecular Weight: 230.313

InChI Key: WAEYKEUXVHQOSI-UHFFFAOYSA-N

3

1 prep out of 1 reactions.

Druglikeness

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3

0 prep out of 1 reactions.

Druglikeness

Identification

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1

1 prep out of 1 reactions.

Druglikeness

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Identification Physical Data (1) Spectra (4)

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1

2 prep out of 2 reactions.

Druglikeness

Identification Physical Data (1)

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3

3 prep

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2

Synthesize | Show Details Find similar Chemical Name: 5-fluoro-3-<(4-piperazinyl)methyl>-1H-indole Reaxys Registry Number: 6145388

Type of Substance: heterocyclic Molecular Formula: C13H16FN3

Linear Structure Formula: C13H16FN3

Molecular Weight: 233.289

InChI Key: PFOFHPUVOGVDPE-UHFFFAOYSA-N 4

Synthesize | Show Details Find similar Chemical Name: N-ethyl-N-piperazinyl-3-indolylmethylamine Reaxys Registry Number: 31231723

Molecular Formula: C15H21N3

Linear Structure Formula: C15H21N3

Molecular Weight: 243.352

InChI Key: UQSASCFTSPWPHK-UHFFFAOYSA-N 5

Synthesize | Show Details Find similar Chemical Name: 3-(4-nitroso-piperazin-1-ylmethyl)-indole Reaxys Registry Number: 618828

CAS Registry Number: 58433-76-4 Type of Substance: heterocyclic Molecular Formula: C13H16N4O Linear Structure Formula: C13H16N4O Molecular Weight: 244.296

InChI Key: ZQSFMPBEDRJMOD-UHFFFAOYSA-N

6

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3-((4-methylpiperazin-1-yl)methyl)-1H-indol-5-amine

7

out of 5 reactions.

Identification Physical Data (1) Spectra (2)

Targets

Reaxys Registry Number: 21044275

CAS Registry Number: 1258296-97-7 Molecular Formula: C14H18FN3

Linear Structure Formula: C14H18FN3

Molecular Weight: 247.315

InChI Key: AWTPQMDTRQRTGS-UHFFFAOYSA-N

1 prep out of 5 reactions.

Druglikeness

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2

Chemical Name: 3-{[4-(prop-2-yn-1-yl)piperazine-1-yl]methyl}-1H-indole

1 prep out of 2 reactions.

Druglikeness

Identification Physical Data (3) Spectra (4)

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1

1 prep out of 1 reactions.

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2

Reaxys Registry Number: 31558193

Molecular Formula: C14H20N4

Linear Structure Formula: C14H20N4

Molecular Weight: 244.34

InChI Key: NSARELUBFYUJHP-UHFFFAOYSA-N

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8

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9

Reaxys Registry Number: 27604335

Molecular Formula: C16H19N3

Linear Structure Formula: C16H19N3

Molecular Weight: 253.347

InChI Key: NWSUXYSNUGRBLB-UHFFFAOYSA-N

Synthesize | Show Details Find similar Chemical Name: 3-((4-methylpiperazin-1-yl)methyl)-1H-indole-5-carbonitrile Reaxys Registry Number: 22705323

CAS Registry Number: 101831-78-1 Molecular Formula: C15H18N4

Linear Structure Formula: C15H18N4

Molecular Weight: 254.335

InChI Key: PVNWVAMWFWITOQ-UHFFFAOYSA-N

10

Synthesize | Show Details Find similar Chemical Name:


3-[(4-acetylpiperazin-1-yl)methyl]-1H-indole

out of 2 reactions.

Bioactivity

Identification Physical Data (3) Spectra (2)

Targets

Reaxys Registry Number: 24294127

Molecular Formula: C14H19N5

Linear Structure Formula: C14H19N5

Molecular Weight: 257.338

InChI Key: JFHFDNKKARCSBD-UHFFFAOYSA-N

no reactions.

Druglikeness

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Chemical Name: N-isopropyl-N-piperazinyl-3-indolylmethylamine

1 prep out of 1 reactions.

Druglikeness

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Identification Physical Data (2) Spectra (4)

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1

1 prep out of 1 reactions.

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2 prep

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2

Reaxys Registry Number: 22848088

CAS Registry Number: 1329045-35-3 Molecular Formula: C15H19N3O Linear Structure Formula: C15H19N3O Molecular Weight: 257.335

InChI Key: UMKHJBUHGGCRGL-UHFFFAOYSA-N

11

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12

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Reaxys Registry Number: 31231726

Molecular Formula: C16H23N3

Linear Structure Formula: C16H23N3

Molecular Weight: 257.379

InChI Key: NARZHCAAZXBIBS-UHFFFAOYSA-N

13

Synthesize | Show Details Find similar Chemical Name: N-aminoethyl-N-piperazinyl-3-indolylmethylamine Reaxys Registry Number: 31231725

Molecular Formula: C15H22N4

Linear Structure Formula: C15H22N4

Molecular Weight: 258.366

InChI Key: JPWDEEQWKASEET-UHFFFAOYSA-N

14

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N-(2″-hydroxyethyl)-N-piperazinyl-3-indolylmethylamine Reaxys Registry Number: 805970

CAS Registry Number: 17511-49-8 Type of Substance: heterocyclic Molecular Formula: C15H21N3O Linear Structure Formula: C15H21N3O Molecular Weight: 259.351

InChI Key: FLOIUBOBDOJASU-UHFFFAOYSA-N

15

out of 2 reactions.

Bioactivity

Identification Physical Data (3)

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4 prep out of 17 reactions.

Druglikeness

Identification Physical Data (5) Spectra (13)

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5

2 prep out of 3 reactions.

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Identification Spectra (1)

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2

1 prep out of 5 reactions.

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1 prep

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1

Synthesize | Show Details Find similar Chemical Name: 5-methoxy-3-[(4-methyl-1-piperazinyl)methyl]-1H-indole Reaxys Registry Number: 11950927

CAS Registry Number: 701205-15-4 Molecular Formula: C15H21N3O Linear Structure Formula: C15H21N3O Molecular Weight: 259.351

InChI Key: LBQPYBWHUQEKBA-UHFFFAOYSA-N

16

Synthesize | Show Details Find similar Chemical Name: 5-chloro-3-(4-methylpiperazin-1-ylmethyl)-1H-indole Reaxys Registry Number: 11950929

CAS Registry Number: 701205-14-3 Molecular Formula: C14H18ClN3

Linear Structure Formula: C14H18ClN3

Molecular Weight: 263.77

InChI Key: GIMOMCJNROQVGI-UHFFFAOYSA-N

17

Synthesize | Show Details Find similar Chemical Name: 3-[(4-ethyl-1-piperazinyl)methyl]-5-methoxy-1H-indole Reaxys Registry Number: 22705325

Molecular Formula: C16H23N3O Linear Structure Formula: C16H23N3O Molecular Weight: 273.378

InChI Key: BRYRTQCGHXJGHS-UHFFFAOYSA-N

18

Synthesize | Show Details Find similar Chemical Name:


N-(2″-methoxyethyl)-N-piperazinyl-3-indolylmethylamine

out of 1 reactions.

Bioactivity

Identification Physical Data (1) Spectra (4)

Targets

2 prep out of 9 reactions.

Druglikeness

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5

Reaxys Registry Number: 30912983

Molecular Formula: C15H21N3S Linear Structure Formula: C15H21N3S Molecular Weight: 275.418

InChI Key: UYKIBHJMUZMXNT-UHFFFAOYSA-N

1 prep out of 2 reactions.

Druglikeness

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Chemical Name: 3-((4-acetylpiperazin-1-yl)methyl)-1H-indole-5-carbonitrile

1 prep out of 1 reactions.

Druglikeness

Identification Spectra (4)

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2

1 prep

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1

Reaxys Registry Number: 31231724

Molecular Formula: C16H23N3O Linear Structure Formula: C16H23N3O Molecular Weight: 273.378

InChI Key: XMJDUTQRNGWTMC-UHFFFAOYSA-N

19

Synthesize | Show Details Find similar Chemical Name: 3-((4-methylpiperazin-1-yl)methyl)-5-nitro-1H-indole Reaxys Registry Number: 1592954

CAS Registry Number: 3414-71-9 Type of Substance: heterocyclic Molecular Formula: C14H18N4O2

Linear Structure Formula: C14H18N4O2

Molecular Weight: 274.323

InChI Key: VGUWZCUCNQXGBU-UHFFFAOYSA-N

20

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21

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Reaxys Registry Number: 22705326

Molecular Formula: C16H18N4O Linear Structure Formula: C16H18N4O Molecular Weight: 282.345

InChI Key: QLHMZJMDKGISAT-UHFFFAOYSA-N

22

Synthesize | Show Details Find similar Chemical Name:


methyl 3-((4-methylpiperazin-1-yl)methyl)-1H-indole-5carboxylate

out of 6 reactions.

Identification Spectra (5)

Targets

Reaxys Registry Number: 25354053

Molecular Formula: C16H21N3O2

Linear Structure Formula: C16H21N3O2

Molecular Weight: 287.362

InChI Key: IWSHHUVABSTWOO-UHFFFAOYSA-N

no reactions.

Druglikeness

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Reaxys Registry Number: 30912980

Molecular Formula: C17H25N3O Linear Structure Formula: C17H25N3O Molecular Weight: 287.405

InChI Key: ZFDIFKWMGRIFIG-UHFFFAOYSA-N

1 prep out of 2 reactions.

Druglikeness

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Chemical Name: 3-((4-phenylpiperazin-1-yl)methyl)-1H-indole

3 prep out of 3 reactions.

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12

1 prep

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1

Reaxys Registry Number: 10274924

CAS Registry Number: 887477-38-5 Type of Substance: heterocyclic Molecular Formula: C16H21N3O2

Linear Structure Formula: C16H21N3O2

Molecular Weight: 287.362

InChI Key: CEZSEVWPLODBQG-UHFFFAOYSA-N

23

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24

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25

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Reaxys Registry Number: 891857

CAS Registry Number: 4281-72-5 Type of Substance: heterocyclic Molecular Formula: C19H21N3

Linear Structure Formula: C19H21N3

Molecular Weight: 291.396

InChI Key: FDOZNCJWYJMHAG-UHFFFAOYSA-N

26

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3-(4-(pyridin-2-yl)piperazin-1-ylmethyl)-1H-indole Reaxys Registry Number: 11950976

CAS Registry Number: 300803-90-1 Molecular Formula: C18H20N4

Linear Structure Formula: C18H20N4

Molecular Weight: 292.384

InChI Key: DGRLQDVYINGXQV-UHFFFAOYSA-N

27

out of 1 reactions.

Identification Spectra (1)

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1 prep out of 1 reactions.

Druglikeness

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2

1 prep out of 1 reactions.

Druglikeness

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1 prep out of 1 reactions.

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1 prep

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1

Synthesize | Show Details Find similar Chemical Name: 3-{[4-(pyrimidin-2-yl)piperazin-1-yl]methyl}-1H-indole Reaxys Registry Number: 9714364

Type of Substance: heterocyclic Molecular Formula: C17H19N5

Linear Structure Formula: C17H19N5

Molecular Weight: 293.371

InChI Key: GKKBEFXMNBECNL-UHFFFAOYSA-N

28

Synthesize | Show Details Find similar Chemical Name: 1-acetoxy-2-(4-indol-3-ylmethyl-piperazin-1-yl)-ethane Reaxys Registry Number: 825069

CAS Registry Number: 17511-51-2 Type of Substance: heterocyclic Molecular Formula: C17H23N3O2

Linear Structure Formula: C17H23N3O2

Molecular Weight: 301.389

InChI Key: SGVVVFMPLMXOMY-UHFFFAOYSA-N

29

Synthesize | Show Details Find similar Chemical Name: 3-(4-benzyl-piperazin-1-ylmethyl)-indole Reaxys Registry Number: 823750

CAS Registry Number: 17511-50-1 Type of Substance: heterocyclic Molecular Formula: C20H23N3

Linear Structure Formula: C20H23N3

Molecular Weight: 305.423

InChI Key: YHZKIEWEQQRAHY-UHFFFAOYSA-N

30

Synthesize | Show Details Find similar Chemical Name:


3-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1H-indole Reaxys Registry Number: 22848089

CAS Registry Number: 414879-27-9 Molecular Formula: C20H23N3

Linear Structure Formula: C20H23N3

Molecular Weight: 305.423

InChI Key: YQZHTUZDSCIWGT-UHFFFAOYSA-N

31

out of 1 reactions.

Bioactivity

Identification Physical Data (1) Spectra (2)

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1 prep out of 1 reactions.

Druglikeness

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1

2 prep out of 4 reactions.

Druglikeness

Identification Spectra (1)

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2

1 prep out of 1 reactions.

Druglikeness

Identification Spectra (4)

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2

2 prep

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5

Synthesize | Show Details Find similar Chemical Name: 3-{[4-(4-methylphenyl)piperazin-1-yl]methyl}-1H-indole Reaxys Registry Number: 22848090

CAS Registry Number: 1403574-74-2 Molecular Formula: C20H23N3

Linear Structure Formula: C20H23N3

Molecular Weight: 305.423

InChI Key: BCJGEKQHRKDXCR-UHFFFAOYSA-N

32

Synthesize | Show Details Find similar Chemical Name: 5-bromo-3-(4-methylpiperazin-1-ylmethyl)-1H-indole Reaxys Registry Number: 11950923

CAS Registry Number: 701205-13-2 Molecular Formula: C14H18BrN3

Linear Structure Formula: C14H18BrN3

Molecular Weight: 308.221

InChI Key: HWXULFBLEGVJDK-UHFFFAOYSA-N

33

Synthesize | Show Details Find similar Chemical Name: (4-((1H-indol-3-yl)methyl)piperazin-1-yl)(furan-2yl)methanone Reaxys Registry Number: 22705329

CAS Registry Number: 383149-20-0 Molecular Formula: C18H19N3O2

Linear Structure Formula: C18H19N3O2

Molecular Weight: 309.368

InChI Key: HZDVQZKEWSXXOR-UHFFFAOYSA-N

34

Synthesize | Show Details Find similar Chemical Name:


3-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1H-indole Reaxys Registry Number: 895145

CAS Registry Number: 20094-55-7 Type of Substance: heterocyclic Molecular Formula: C19H20FN3

Linear Structure Formula: C19H20FN3

Molecular Weight: 309.386

InChI Key: PCLWAFVRAWUFRN-UHFFFAOYSA-N

35

out of 2 reactions.

Bioactivity

Identification Physical Data (4) Spectra (4)

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1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Physical Data (1) Spectra (2)

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1

2 prep out of 9 reactions.

Druglikeness

Bioactivity

Identification Physical Data (2) Spectra (4)

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2

1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Physical Data (1) Spectra (7)

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3

1 prep

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1

Synthesize | Show Details Find similar Chemical Name: 3-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-1H-indole Reaxys Registry Number: 22848092

CAS Registry Number: 414886-17-2 Molecular Formula: C19H20FN3

Linear Structure Formula: C19H20FN3

Molecular Weight: 309.386

InChI Key: CKNQLJYCQLEECC-UHFFFAOYSA-N

36

Synthesize | Show Details Find similar Chemical Name: N-tert-butyloxycarbonyl-N-piperazinyl-3-indolylmethylamine Reaxys Registry Number: 30912989

Molecular Formula: C18H25N3O2

Linear Structure Formula: C18H25N3O2

Molecular Weight: 315.415

InChI Key: AUYCPBVTVLXBOP-UHFFFAOYSA-N

37

Synthesize | Show Details Find similar Chemical Name: 3-((4-phenylpiperazin-1-yl)methyl)-1H-indole-5-carbonitrile Reaxys Registry Number: 8788757

Type of Substance: heterocyclic Molecular Formula: C20H20N4

Linear Structure Formula: C20H20N4

Molecular Weight: 316.406

InChI Key: VHPASGHENHNLAW-UHFFFAOYSA-N

38

Synthesize | Show Details Find similar Chemical Name:


3-{[4-(2-cyanophenyl)piperazin-1-yl]methyl}-1H-indole Reaxys Registry Number: 22848094

CAS Registry Number: 1403574-75-3 Molecular Formula: C20H20N4

Linear Structure Formula: C20H20N4

Molecular Weight: 316.406

InChI Key: NJGIWDIZAGDKTQ-UHFFFAOYSA-N

39

out of 1 reactions.

Bioactivity

Identification Physical Data (1) Spectra (2)

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1 prep out of 1 reactions.

Druglikeness

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2

1 prep out of 1 reactions.

Druglikeness

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1

1 prep out of 1 reactions.

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Bioactivity

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2

1 prep

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1

Synthesize | Show Details Find similar Chemical Name: ethyl 4-((5-methoxy-1H-indol-3-yl)methyl)piperazine-1carboxylate Reaxys Registry Number: 22705330

Molecular Formula: C17H23N3O3

Linear Structure Formula: C17H23N3O3

Molecular Weight: 317.388

InChI Key: HBYFKBGXGNUEIV-UHFFFAOYSA-N

40

Synthesize | Show Details Find similar Chemical Name: 3-[(4-benzoylpiperazin-1-yl)methyl]-1H-indole Reaxys Registry Number: 22848093

CAS Registry Number: 353772-99-3 Molecular Formula: C20H21N3O Linear Structure Formula: C20H21N3O Molecular Weight: 319.406

InChI Key: IUSKODVEAJAQAA-UHFFFAOYSA-N

41

Synthesize | Show Details Find similar Chemical Name: 3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl}-1H-indole Reaxys Registry Number: 9720921

Type of Substance: heterocyclic Molecular Formula: C21H25N3

Linear Structure Formula: C21H25N3

Molecular Weight: 319.45

InChI Key: WPTJQRPJBCUVFJ-UHFFFAOYSA-N

42

Synthesize | Show Details Find similar Chemical Name:


3-(4-benzyl-piperazin-1-ylmethyl)-indol-5-ylamine Reaxys Registry Number: 1594683

CAS Registry Number: 3414-78-6 Type of Substance: heterocyclic Molecular Formula: C20H24N4

Linear Structure Formula: C20H24N4

Molecular Weight: 320.437

InChI Key: FOXCFIPZINDAQU-UHFFFAOYSA-N

43

out of 1 reactions.

Bioactivity

Identification Physical Data (1)

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0 prep out of 1 reactions.

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1

2 prep out of 2 reactions.

Druglikeness

Bioactivity

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4

1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Physical Data (1) Spectra (5)

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3

1 prep

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1

Synthesize | Show Details Find similar Chemical Name: 2-(4-((5-chloro-1H-indol-3-yl)methyl)piperazin-1-yl)-N,Ndimethylethan-1-amine Reaxys Registry Number: 28456677

Molecular Formula: C17H25ClN4

Linear Structure Formula: C17H25ClN4

Molecular Weight: 320.865

InChI Key: MIXDYGNDLHIDQK-UHFFFAOYSA-N

44

Synthesize | Show Details Find similar Chemical Name: 3-[4-(o-methoxyphenyl)-piperazin-1-ylmethyl]-1H-indole Reaxys Registry Number: 9717898

Type of Substance: heterocyclic Molecular Formula: C20H23N3O Linear Structure Formula: C20H23N3O Molecular Weight: 321.422

InChI Key: OJUQWLAXOIFADL-UHFFFAOYSA-N

45

Synthesize | Show Details Find similar Chemical Name: 3-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-1H-indole Reaxys Registry Number: 22705328

CAS Registry Number: 864389-09-3 Molecular Formula: C20H23N3O Linear Structure Formula: C20H23N3O Molecular Weight: 321.422

InChI Key: CRJJXHKBVLJRSW-UHFFFAOYSA-N

46

Synthesize | Show Details Find similar Chemical Name:


3-{[4-(3-methoxyphenyl)piperazin-1-yl]methyl}-1H-indole Reaxys Registry Number: 22848091

CAS Registry Number: 1403574-73-1 Molecular Formula: C20H23N3O Linear Structure Formula: C20H23N3O Molecular Weight: 321.422

InChI Key: OHTKFJKZUCVOHW-UHFFFAOYSA-N

47

out of 1 reactions.

Bioactivity

Identification Physical Data (1) Spectra (2)

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1 prep out of 1 reactions.

Druglikeness

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2

1 prep out of 1 reactions.

Druglikeness

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1

2 prep out of 2 reactions.

Druglikeness

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7

1 prep

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2

Synthesize | Show Details Find similar Chemical Name: 5-bromo-3-((4-ethylpiperazin-1-yl)methyl)-1H-indole Reaxys Registry Number: 22705324

Molecular Formula: C15H20BrN3

Linear Structure Formula: C15H20BrN3

Molecular Weight: 322.248

InChI Key: BCECHAQMJIAGTH-UHFFFAOYSA-N

48

Synthesize | Show Details Find similar Chemical Name: 5-methoxy-3-(4-(pyridin-2-yl)piperazin-1-ylmethyl)-1H-indole Reaxys Registry Number: 11951037

CAS Registry Number: 701205-19-8 Molecular Formula: C19H22N4O Linear Structure Formula: C19H22N4O Molecular Weight: 322.41

InChI Key: PDOAZUDGOPEDOO-UHFFFAOYSA-N

49

Synthesize | Show Details Find similar Chemical Name: 3-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-1H-indole Reaxys Registry Number: 7543323

Type of Substance: heterocyclic Molecular Formula: C19H20ClN3

Linear Structure Formula: C19H20ClN3

Molecular Weight: 325.841

InChI Key: NRWWWLAGZMNIDV-UHFFFAOYSA-N

50

Synthesize | Show Details Find similar Chemical Name:


3-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-1H-indole

out of 1 reactions.

Bioactivity

Identification Physical Data (2) Spectra (4)

Targets

1 prep out of 1 reactions.

Druglikeness

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2

1 prep out of 1 reactions.

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Reaxys Registry Number: 30912981

Molecular Formula: C16H20F3N3O Linear Structure Formula: C16H20F3N3O Molecular Weight: 327.35

InChI Key: ODDYQUQEULJVME-UHFFFAOYSA-N

1 prep out of 2 reactions.

Druglikeness

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Chemical Name:

1 prep

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1

Reaxys Registry Number: 9718412

Type of Substance: heterocyclic Molecular Formula: C19H20ClN3

Linear Structure Formula: C19H20ClN3

Molecular Weight: 325.841

InChI Key: WQILKYINSSRSAR-UHFFFAOYSA-N

51

Synthesize | Show Details Find similar Chemical Name: 3-{[4-(2-chlorophenyl)piperazin-1-yl]methyl}-1H-indole Reaxys Registry Number: 9718517

Type of Substance: heterocyclic Molecular Formula: C19H20ClN3

Linear Structure Formula: C19H20ClN3

Molecular Weight: 325.841

InChI Key: CMZLSJOICXCPRS-UHFFFAOYSA-N

52

Synthesize | Show Details Find similar Chemical Name: 1-[(4-indol-3-ylmethyl-piperazin-1-yl)-acetyl]-pyrrolidine Reaxys Registry Number: 841199

CAS Registry Number: 34933-60-3 Type of Substance: heterocyclic Molecular Formula: C19H26N4O Linear Structure Formula: C19H26N4O Molecular Weight: 326.442

InChI Key: NZMLXAWUARKVPT-UHFFFAOYSA-N

53

Synthesize | Show Details Find similar

54

Synthesize | Show Details Find similar


3-(4-cinnamylpiperazin-1-ylmethyl)-1H-indole

out of 1 reactions.

Bioactivity

Identification Physical Data (1) Spectra (2)

Targets

1 prep out of 1 reactions.

Druglikeness

Identification Physical Data (1)

Show Targets

1

1 prep out of 1 reactions.

Druglikeness

Identification Spectra (4)

Show Targets

2

Reaxys Registry Number: 8793130

Type of Substance: heterocyclic Molecular Formula: C20H19FN4

Linear Structure Formula: C20H19N4F Molecular Weight: 334.396

InChI Key: WSJMJBOZYZWDIK-UHFFFAOYSA-N

1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Physical Data (1) Spectra (2)

Show Targets

1

Chemical Name:

1 prep

Druglikeness

Show

3

Reaxys Registry Number: 9719223

Type of Substance: heterocyclic Molecular Formula: C22H25N3

Linear Structure Formula: C22H25N3

Molecular Weight: 331.461

InChI Key: IGNXYLSQDZTEII-UHFFFAOYSA-N

55

Synthesize | Show Details Find similar Chemical Name: 1-[3-(4-phenyl-piperazin-1-ylmethyl)-indol-5-yl]-ethanone Reaxys Registry Number: 568236

CAS Registry Number: 17740-70-4 Type of Substance: heterocyclic Molecular Formula: C21H23N3O Linear Structure Formula: C21H23N3O Molecular Weight: 333.433

InChI Key: ZIQZINPFRFQMHE-UHFFFAOYSA-N

56

Synthesize | Show Details Find similar Chemical Name: 3-((4-(furan-2-carbonyl)piperazin-1-yl)methyl)-1H-indole-5carbonitrile Reaxys Registry Number: 22705333

Molecular Formula: C19H18N4O2

Linear Structure Formula: C19H18N4O2

Molecular Weight: 334.378

InChI Key: UTOOYLPWUKZMGS-UHFFFAOYSA-N

57

Synthesize | Show Details Find similar

58

Synthesize | Show Details Find similar


N-(4-indol-3-ylmethyl-piperazin-1-yl)-benzamide

out of 1 reactions.

Bioactivity

Identification Physical Data (2)

Targets

no reactions.

Druglikeness

Identification

Show Targets

1

Reaxys Registry Number: 24363549

Molecular Formula: C20H21N3O2

Linear Structure Formula: C20H21N3O2

Molecular Weight: 335.406

InChI Key: ZGHMWJXLYLNOOG-UHFFFAOYSA-N

no reactions.

Druglikeness

Bioactivity

Identification

Show Targets

1

Chemical Name: 3-{[4-(2-ethoxyphenyl)-piperazin-1-yl]methyl}-1H-indole

2 prep out of 2 reactions.

Druglikeness

Bioactivity

Identification Physical Data (1) Spectra (2) Other Data (21)

Show Targets

5

1 prep

Druglikeness

Show

1

Reaxys Registry Number: 626554

CAS Registry Number: 58434-18-7 Type of Substance: heterocyclic Molecular Formula: C20H22N4O Linear Structure Formula: C20H22N4O Molecular Weight: 334.421

InChI Key: HBJTWTRJRLCVMM-UHFFFAOYSA-N

59

Synthesize | Show Details Find similar Chemical Name: 3-[4-(3-dimethylaminophenyl)piperazin-1-yl]methylindole Reaxys Registry Number: 11725005

Molecular Formula: C21H26N4

Linear Structure Formula: C21H26N4

Molecular Weight: 334.464

InChI Key: SCMROHOCVMNFAC-UHFFFAOYSA-N

60

Synthesize | Show Details Find similar

61

Synthesize | Show Details Find similar

Reaxys Registry Number: 19916687

CAS Registry Number: 414882-56-7 Molecular Formula: C21H25N3O Linear Structure Formula: C21H25N3O Molecular Weight: 335.449

InChI Key: PFALMGBZVKYODL-UHFFFAOYSA-N

62

Synthesize | Show Details Find similar Chemical Name:


3-{[4-(4-nitrophenyl)piperazin-1-yl]methyl}-1H-indole Reaxys Registry Number: 22848095

CAS Registry Number: 414882-99-8 Molecular Formula: C19H20N4O2

Linear Structure Formula: C19H20N4O2

Molecular Weight: 336.393

InChI Key: QEOATOUNLDHSQK-UHFFFAOYSA-N

63

out of 1 reactions.

Bioactivity

Identification Physical Data (1) Spectra (2)

Targets

0 prep out of 1 reactions.

Druglikeness

Identification

Show Targets

1

1 prep out of 2 reactions.

Druglikeness

Identification

Show Targets

1

1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Physical Data (2) Spectra (3)

Show Targets

2

3 prep

Druglikeness

Show

1

Synthesize | Show Details Find similar Chemical Name: 4-(1H-indole-3-ylmethyl)-N-pyrazin-2-ylpiperazine-1carboxamide Reaxys Registry Number: 19135936

CAS Registry Number: 1008772-06-2 Molecular Formula: C18H20N6O Linear Structure Formula: C18H20N6O Molecular Weight: 336.396

InChI Key: WVNIKZYMGSQHQC-UHFFFAOYSA-N

64

Synthesize | Show Details Find similar Chemical Name: 5-fluoro-3-((4-(2-methoxyphenyl)piperazin-1-yl)methyl)-1Hindole Reaxys Registry Number: 28456679

Molecular Formula: C20H22FN3O Linear Structure Formula: C20H22FN3O Molecular Weight: 339.413

InChI Key: FNHBWTJWVSZPGZ-UHFFFAOYSA-N

65

Synthesize | Show Details Find similar Chemical Name: 3-{[4-(2,5-difluorobenzyl)piperazin-1-yl]methyl}-1H-indole Reaxys Registry Number: 22604931

CAS Registry Number: 1345510-79-3 Molecular Formula: C20H21F2N3

Linear Structure Formula: C20H21F2N3

Molecular Weight: 341.404

InChI Key: QXMZXABRBSZENN-UHFFFAOYSA-N

66

Synthesize | Show Details Find similar Reaxys Registry Number: 5302588


CAS Registry Number: 75410-86-5 Type of Substance: heterocyclic Molecular Formula: C22H22N4

Linear Structure Formula: C22H22N4

Molecular Weight: 342.443

InChI Key: JDBVHYBVEROAAP-UHFFFAOYSA-N

out of 3 reactions.

Identification

Targets

Chemical Name: N,N'-bis(indol-3-ylmethyl)piperazine

5 prep out of 5 reactions.

Druglikeness

Bioactivity

Identification Physical Data (4) Spectra (4)

Show Targets

7

3 prep out of 12 reactions.

Druglikeness

Identification Spectra (2)

Show Targets

2

1 prep out of 1 reactions.

Druglikeness

Identification Spectra (4)

Show Targets

2

1 prep

Druglikeness

Show

1

67

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Reaxys Registry Number: 337578

CAS Registry Number: 35713-31-6 Type of Substance: heterocyclic Molecular Formula: C22H24N4

Linear Structure Formula: C22H24N4

Molecular Weight: 344.459

InChI Key: WSJVQTJWVHONKW-UHFFFAOYSA-N

68

Synthesize | Show Details Find similar Chemical Name: 3-[(t-butyloxycarbonylpiperazin-4-yl)methyl]-5-methoxy-1Hindole Reaxys Registry Number: 29258003

Molecular Formula: C19H27N3O3

Linear Structure Formula: C19H27N3O3

Molecular Weight: 345.442

InChI Key: KLWSFLZYJPOGSH-UHFFFAOYSA-N

69

Synthesize | Show Details Find similar Chemical Name: 3-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-1H-indole-5carbonitrile Reaxys Registry Number: 22705334

Molecular Formula: C21H22N4O Linear Structure Formula: C21H22N4O Molecular Weight: 346.432

InChI Key: GOKLXLVAHUBTTB-UHFFFAOYSA-N

70

Synthesize | Show Details Find similar Reaxys Registry Number: 9077921


Type of Substance: heterocyclic Molecular Formula: C21H23N3O2

Linear Structure Formula: C21H23N3O2

Molecular Weight: 349.433

InChI Key: FFBXVXKKCLEHIZ-UHFFFAOYSA-N

out of 1 reactions.

Bioactivity

Identification Physical Data (1) Spectra (3)

Targets

Chemical Name: 3-[4-(2,3-Dihydro-benzo[1,4]dioxin-5-yl)-piperazin-1-ylmethyl]-1H-indole

1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Physical Data (3) Spectra (4)

Show Targets

3

1 prep out of 1 reactions.

Druglikeness

Identification Spectra (1)

Show Targets

1

no reactions.

Druglikeness

Bioactivity

Identification

Show Targets

1

1 prep

Druglikeness

Show

1

71

Synthesize | Show Details Find similar

Reaxys Registry Number: 10289365

Type of Substance: heterocyclic Molecular Formula: C21H23N3O2

Linear Structure Formula: C21H23N3O2

Molecular Weight: 349.433

InChI Key: UVQHGCKWFYZHSI-UHFFFAOYSA-N

72

Synthesize | Show Details Find similar Chemical Name: 3-(4-(benzyloxycarbonyl)piperazin-1-ylmethyl)-1H-indole Reaxys Registry Number: 11672248

Molecular Formula: C21H23N3O2

Linear Structure Formula: C21H23N3O2

Molecular Weight: 349.433

InChI Key: FSVZKNGFNVSDKP-UHFFFAOYSA-N

73

Synthesize | Show Details Find similar Chemical Name: HTS 06142 Reaxys Registry Number: 21558056

CAS Registry Number: 355396-63-3 Molecular Formula: C21H23N3O2

Linear Structure Formula: C21H23N3O2

Molecular Weight: 349.433

InChI Key: COEIFRBEMCGQEN-UHFFFAOYSA-N

74

Synthesize | Show Details Find similar Chemical Name:


3-(4-benzyl-piperazin-1-ylmethyl)-5-nitro-indole

out of 2 reactions.

Bioactivity

Identification Physical Data (2)

Targets

Reaxys Registry Number: 8792889

Type of Substance: heterocyclic Molecular Formula: C20H19ClN4

Linear Structure Formula: C20H19N4Cl Molecular Weight: 350.851

InChI Key: SNFLVHDMWFYRRB-UHFFFAOYSA-N

1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Physical Data (1) Spectra (3)

Show Targets

1

Reaxys Registry Number: 8793434

Type of Substance: heterocyclic Molecular Formula: C20H19ClN4

Linear Structure Formula: C20H19N4Cl Molecular Weight: 350.851

InChI Key: HYLGECOKUPPDRN-UHFFFAOYSA-N

1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Physical Data (1) Spectra (2)

Show Targets

1

Chemical Name: 5-methoxy-3-((4-(2-methoxyphenyl)piperazin-1yl)methyl)-1H-indole

2 prep out of 2 reactions.

Druglikeness

Identification Spectra (5)

Show Targets

3

1 prep

Druglikeness

Show

3

Reaxys Registry Number: 1603558

CAS Registry Number: 3414-72-0 Type of Substance: heterocyclic Molecular Formula: C20H22N4O2

Linear Structure Formula: C20H22N4O2

Molecular Weight: 350.42

InChI Key: PKVAMSCYQLIVLR-UHFFFAOYSA-N

75

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76

Synthesize | Show Details Find similar

77

Synthesize | Show Details Find similar

Reaxys Registry Number: 11951133

CAS Registry Number: 701205-17-6 Molecular Formula: C21H25N3O2

Linear Structure Formula: C21H25N3O2

Molecular Weight: 351.448

InChI Key: MBYXPBOWSBKBJN-UHFFFAOYSA-N

78

Synthesize | Show Details Find similar Chemical Name:


4-fluoro-N-(4-indol-3-ylmethyl-piperazin-1-yl)-benzamide Reaxys Registry Number: 628593

CAS Registry Number: 58434-20-1 Type of Substance: heterocyclic Molecular Formula: C20H21FN4O Linear Structure Formula: C20H21FN4O Molecular Weight: 352.411

InChI Key: BHBRWSQWUNNUOO-UHFFFAOYSA-N

79

out of 1 reactions.

Bioactivity

Identification Physical Data (2)

Targets

no reactions.

Druglikeness

Identification

Show Targets

1

1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Physical Data (1) Spectra (1)

Show Targets

1

no reactions.

Druglikeness

Identification

Show Targets

1

1 prep

Druglikeness

Show

1

Synthesize | Show Details Find similar Chemical Name: 3-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]methylindole Reaxys Registry Number: 11725009

Molecular Formula: C20H22ClN3O Linear Structure Formula: C20H22ClN3O Molecular Weight: 355.867

InChI Key: LSSGXUSYGHZTJW-UHFFFAOYSA-N

80

Synthesize | Show Details Find similar Chemical Name: 3-[4-(m-trifluoromethylphenyl)-piperazin-1-ylmethyl]-1Hindole Reaxys Registry Number: 9726366

Type of Substance: heterocyclic Molecular Formula: C20H20F3N3

Linear Structure Formula: C20H20F3N3

Molecular Weight: 359.394

InChI Key: CVIYNLVHJXVVIA-UHFFFAOYSA-N

81

Synthesize | Show Details Find similar Chemical Name: 5-chloro-3-[4-(4-chlorophenyl)piperazin-1-yl]methylindole Reaxys Registry Number: 11725008

Molecular Formula: C19H19Cl2N3

Linear Structure Formula: C19H19Cl2N3

Molecular Weight: 360.286

InChI Key: XUCYZJZBUAWKGX-UHFFFAOYSA-N

82

Synthesize | Show Details Find similar Chemical Name:


3-{[4-(2,3-dichlorophenyl)-piperazin-1-yl]methyl}-1H-indole

out of 1 reactions.

Bioactivity

Identification Physical Data (1) Spectra (2)

Targets

Reaxys Registry Number: 25966194

CAS Registry Number: 1348317-84-9 Molecular Formula: C19H20ClN3*ClH Linear Structure Formula: C19H20ClN3*ClH Molecular Weight: 362.302

InChI Key: NIOIXSOSEQDRML-UHFFFAOYSA-N

no reactions.

Druglikeness

Bioactivity

Identification

Show Targets

1

Chemical Name: 2-(4-((5-chloro-1H-indol-3-yl)methyl)piperazin-1-yl)-N,Ndimethylethan-1-amine formic acid salt

1 prep out of 1 reactions.

Druglikeness

Identification Physical Data (2) Spectra (3)

Show Targets

1

1 prep out of 1 reactions.

Druglikeness

Identification Spectra (4)

Show Targets

2

1 prep

Druglikeness

Show

1

Reaxys Registry Number: 23870534

CAS Registry Number: 1451194-28-7 Molecular Formula: C19H19Cl2N3

Linear Structure Formula: C19H19Cl2N3

Molecular Weight: 360.286

InChI Key: SVSNQBMLUDOWHS-UHFFFAOYSA-N

83

Synthesize | Show Details Find similar

84

Synthesize | Show Details Find similar

Reaxys Registry Number: 28456678

Molecular Formula: CH2O2*C17H25ClN4

Linear Structure Formula: C17H25ClN4*CH2O2

Molecular Weight: 366.891

InChI Key: POLNIUXNISKWMR-UHFFFAOYSA-N

85

Synthesize | Show Details Find similar Chemical Name: 5-bromo-3-((4-phenylpiperazin-1-yl)methyl)-1H-indole Reaxys Registry Number: 22705327

Molecular Formula: C19H20BrN3

Linear Structure Formula: C19H20BrN3

Molecular Weight: 370.292

InChI Key: WUFFRSHCMYNTJG-UHFFFAOYSA-N

86

Synthesize | Show Details Find similar Chemical Name:


5-bromo-3-(4-(pyridin-2-yl)piperazin-1-ylmethyl)-1H-indole

out of 1 reactions.

Identification Spectra (1)

Targets

Reaxys Registry Number: 25587862

Molecular Formula: C20H28N4O3

Linear Structure Formula: C20H28N4O3

Molecular Weight: 372.467

InChI Key: YKNWOJOWNPOJRJ-UHFFFAOYSA-N

no reactions.

Druglikeness

Bioactivity

Identification

Show Targets

2

Chemical Name: 3-{[4-(3,4-dichlorobenzyl)piperazin-1-yl]methyl}-1H-indole

1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Physical Data (2) Spectra (3)

Show Targets

2

2 prep out of 2 reactions.

Druglikeness

Bioactivity

Identification Spectra (3)

Show Targets

1

1 prep

Druglikeness

Show

1

Reaxys Registry Number: 11951030

CAS Registry Number: 701205-18-7 Molecular Formula: C18H19BrN4

Linear Structure Formula: C18H19BrN4

Molecular Weight: 371.28

InChI Key: PINBXRZSNRLKID-UHFFFAOYSA-N

87

Synthesize | Show Details Find similar

88

Synthesize | Show Details Find similar

Reaxys Registry Number: 22604930

CAS Registry Number: 1345510-80-6 Molecular Formula: C20H21Cl2N3

Linear Structure Formula: C20H21Cl2N3

Molecular Weight: 374.313

InChI Key: GBYXTIZDOIKXPZ-UHFFFAOYSA-N

89

Synthesize | Show Details Find similar Chemical Name: 4-(4-((1H-indol-3-yl)methyl)piperazin-1-yl)-7-chloroquinoline Reaxys Registry Number: 29599928

Molecular Formula: C22H21ClN4

Linear Structure Formula: C22H21ClN4

Molecular Weight: 376.889

InChI Key: YSZQCJMJIIWGKU-UHFFFAOYSA-N

90

Synthesize | Show Details Find similar Chemical Name:


3-((4-(2,3-dichlorophenyl)piperazin-1-yl)methyl)-5-fluoro-1Hindole

out of 1 reactions.

Identification Physical Data (2) Spectra (3)

Targets

1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Spectra (1)

Show Targets

2

Reaxys Registry Number: 19332291

CAS Registry Number: 1166813-01-9 Molecular Formula: C19H19F2N7

Linear Structure Formula: C19H19F2N7

Molecular Weight: 383.404

InChI Key: YKSTVEVHSRIWRH-UHFFFAOYSA-N

1 prep out of 1 reactions.

Bioactivity

Identification Spectra (2)

Show Targets

2

Reaxys Registry Number: 8798976

Type of Substance: heterocyclic Molecular Formula: C20H18Cl2N4

Linear Structure Formula: C20H18N4Cl2

Molecular Weight: 385.296

InChI Key: LLMBUJCYVGLEBH-UHFFFAOYSA-N

1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Physical Data (1) Spectra (3)

Show Targets

1

Chemical Name:

2 prep

Druglikeness

Show

1

Reaxys Registry Number: 28456685

Molecular Formula: C19H18Cl2FN3

Linear Structure Formula: C19H18Cl2FN3

Molecular Weight: 378.276

InChI Key: KRVNZLXHWSPXEE-UHFFFAOYSA-N

91

Synthesize | Show Details Find similar Chemical Name: [3-(4-cyclobutyl-piperazin-1-ylmethyl)-1H-indol-5-yl]-piperidin1-yl-methanone Reaxys Registry Number: 18483400

CAS Registry Number: 1056000-42-0 Molecular Formula: C23H32N4O Linear Structure Formula: C23H32N4O Molecular Weight: 380.533

InChI Key: XNTLEJQKHHOXOJ-UHFFFAOYSA-N

92

Synthesize | Show Details Find similar

93

Synthesize | Show Details Find similar

94

Synthesize | Show Details Find similar


5-fluoro-3-((4-(2-methoxyphenyl)piperazin-1-yl)methyl)-1Hindole formic acid salt

out of 2 reactions.

Identification Physical Data (1) Spectra (3)

Targets

no reactions.

Druglikeness

Identification

Show Targets

1

Reaxys Registry Number: 25587847

Molecular Formula: C21H30N4O3

Linear Structure Formula: C21H30N4O3

Molecular Weight: 386.494

InChI Key: UYQOFILLYJJDJD-UHFFFAOYSA-N

no reactions.

Druglikeness

Bioactivity

Identification

Show Targets

2

Chemical Name: N-[N-(3-indolylmethyl)-aminoethyl]-N-piperazinyl-3indolylmethylamine

1 prep out of 1 reactions.

Druglikeness

Bioactivity

Identification Physical Data (1) Spectra (4)

Show Targets

1

1 prep

Druglikeness

Show

2

Reaxys Registry Number: 28456680

Molecular Formula: CH2O2*C20H22FN3O Linear Structure Formula: C20H22FN3O*CH2O2

Molecular Weight: 385.438

InChI Key: CVQDWSOBERUNJM-UHFFFAOYSA-N

95

Synthesize | Show Details Find similar Chemical Name: 3-[4-(4-chloro-2,5-dimethoxyphenyl)piperazin-1yl]methylindole Reaxys Registry Number: 11725014

Molecular Formula: C21H24ClN3O2

Linear Structure Formula: C21H24ClN3O2

Molecular Weight: 385.893

InChI Key: DWFKVFVRIJSCBL-UHFFFAOYSA-N

96

Synthesize | Show Details Find similar

97

Synthesize | Show Details Find similar

Reaxys Registry Number: 31231727

Molecular Formula: C24H29N5

Linear Structure Formula: C24H29N5

Molecular Weight: 387.528

InChI Key: NPDSIOQSXZZAFX-UHFFFAOYSA-N

98

Synthesize | Show Details Find similar Reaxys Registry Number: 22705331


Molecular Formula: C18H18BrN3O2

Linear Structure Formula: C18H18BrN3O2

Molecular Weight: 388.264

InChI Key: KWSRXGSGJKPCNC-UHFFFAOYSA-N

99

Synthesize | Show Details Find similar

out of 1 reactions.

Identification Physical Data (1) Spectra (7)

Targets


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