N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide

C137H163F4N21O7 — CID 158962644

IUPACN-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide
SMILESCC(=O)NCc1ccc2c(C#N)cn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.CC(=O)NCc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.CC(=O)NCc1ccc2ccn(C3CCN(CCc4cccnc4)CC3)c2c1.CC(=O)NCc1ccc2ccn(C3CCNCC3)c2c1.CN(C)C(=O)NCc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.O=C(CO)NCc1ccc2ccn(C3CCN(CCc4ccccc4F)CC3)c2c1
InChIInChI=1S/C25H31FN4O.C25H27FN4O.C24H28FN3O2.C24H28FN3O.C23H28N4O.C16H21N3O/c1-28(2)25(31)27-18-20-3-6-21-10-16-30(24(21)17-20)23-11-14-29(15-12-23)13-9-19-4-7-22(26)8-5-19;1-18(31)28-16-20-4-7-24-21(15-27)17-30(25(24)14-20)23-9-12-29(13-10-23)11-8-19-2-5-22(26)6-3-19;25-22-4-2-1-3-19(22)7-11-27-12-9-21(10-13-27)28-14-8-20-6-5-18(15-23(20)28)16-26-24(30)17-29;1-18(29)26-17-20-2-5-21-9-15-28(24(21)16-20)23-10-13-27(14-11-23)12-8-19-3-6-22(25)7-4-19;1-18(28)25-17-20-4-5-21-7-14-27(23(21)15-20)22-8-12-26(13-9-22)11-6-19-3-2-10-24-16-19;1-12(20)18-11-13-2-3-14-6-9-19(16(14)10-13)15-4-7-17-8-5-15/h3-8,10,16-17,23H,9,11-15,18H2,1-2H3,(H,27,31);2-7,14,17,23H,8-13,16H2,1H3,(H,28,31);1-6,8,14-15,21,29H,7,9-13,16-17H2,(H,26,30);2-7,9,15-16,23H,8,10-14,17H2,1H3,(H,26,29);2-5,7,10,14-16,22H,6,8-9,11-13,17H2,1H3,(H,25,28);2-3,6,9-10,15,17H,4-5,7-8,11H2,1H3,(H,18,20)
InChIKeyJMUSDAZHPNOUJB-UHFFFAOYSA-N
MW2291.94 g/mol
LogP21.92
Rot. Bonds34

About N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide

N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide (PubChem CID 158962644) has the molecular formula C137H163F4N21O7 and a molecular weight of 2291.94 g/mol. Its IUPAC name is N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide
PubChem CID158962644
Molecular FormulaC137H163F4N21O7
Molecular Weight2291.94 g/mol
Exact Mass2290.30
IUPAC NameN-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide
SMILESCC(=O)NCc1ccc2c(C#N)cn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.CC(=O)NCc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.CC(=O)NCc1ccc2ccn(C3CCN(CCc4cccnc4)CC3)c2c1.CC(=O)NCc1ccc2ccn(C3CCNCC3)c2c1.CN(C)C(=O)NCc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.O=C(CO)NCc1ccc2ccn(C3CCN(CCc4ccccc4F)CC3)c2c1
InChIInChI=1S/C25H31FN4O.C25H27FN4O.C24H28FN3O2.C24H28FN3O.C23H28N4O.C16H21N3O/c1-28(2)25(31)27-18-20-3-6-21-10-16-30(24(21)17-20)23-11-14-29(15-12-23)13-9-19-4-7-22(26)8-5-19;1-18(31)28-16-20-4-7-24-21(15-27)17-30(25(24)14-20)23-9-12-29(13-10-23)11-8-19-2-5-22(26)6-3-19;25-22-4-2-1-3-19(22)7-11-27-12-9-21(10-13-27)28-14-8-20-6-5-18(15-23(20)28)16-26-24(30)17-29;1-18(29)26-17-20-2-5-21-9-15-28(24(21)16-20)23-10-13-27(14-11-23)12-8-19-3-6-22(25)7-4-19;1-18(28)25-17-20-4-5-21-7-14-27(23(21)15-20)22-8-12-26(13-9-22)11-6-19-3-2-10-24-16-19;1-12(20)18-11-13-2-3-14-6-9-19(16(14)10-13)15-4-7-17-8-5-15/h3-8,10,16-17,23H,9,11-15,18H2,1-2H3,(H,27,31);2-7,14,17,23H,8-13,16H2,1H3,(H,28,31);1-6,8,14-15,21,29H,7,9-13,16-17H2,(H,26,30);2-7,9,15-16,23H,8,10-14,17H2,1H3,(H,26,29);2-5,7,10,14-16,22H,6,8-9,11-13,17H2,1H3,(H,25,28);2-3,6,9-10,15,17H,4-5,7-8,11H2,1H3,(H,18,20)
InChIKeyJMUSDAZHPNOUJB-UHFFFAOYSA-N
XLogP21.92
TPSA292.56 Ų
H-Bond Donors8
H-Bond Acceptors21
Rotatable Bonds34
Heavy Atoms169
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002291.94
LogP ≤ 521.92
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1021

Analyze N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(2,2-difluoroethyl)-7-(6-fluoro-3-pyridinyl)pyrido[4,3-b]indole;5-(2-fluoroethyl)-7-(6-fluoro-3-pyridinyl)pyrido[4,3-b]indole;4-fluoro-7-(6-fluoro-3-pyridinyl)-5-methylpyrido[4,3-b]indole;5-(8-fluoro-5-methylpyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;5-(9-fluoro-5-methylpyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;7-(6-fluoro-3-pyridinyl)-5-methylpyrido[4,3-b]indole;7-(6-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole;7-(6-fluoro-3-pyridinyl)-5-(2,2,2-trifluoroethyl)pyrido[4,3-b]indole
CID 157145350
5-[5-(2,2-difluoroethyl)pyrido[4,3-b]indol-7-yl]-1H-pyridin-2-one;5-[5-(2-fluoroethyl)pyrido[4,3-b]indol-7-yl]-1H-pyridin-2-one;8-fluoro-5-methyl-7-pyridin-3-ylpyrido[4,3-b]indole;9-fluoro-5-methyl-7-pyridin-3-ylpyrido[4,3-b]indole;5-(5-methylpyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;5-(5H-pyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;5-[5-(2,2,2-trifluoroethyl)pyrido[4,3-b]indol-7-yl]-1H-pyridin-2-one
CID 160465750
5-[5-(2,2-difluoroethyl)pyrido[4,3-b]indol-7-yl]-1H-pyridin-2-one;5-(8,9-difluoro-5-methylpyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;5-[5-(2-fluoroethyl)pyrido[4,3-b]indol-7-yl]-1H-pyridin-2-one;9-fluoro-5-methyl-7-pyridin-3-ylpyrido[4,3-b]indole;5-(4-fluoro-5-methylpyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;5-(5-methylpyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;5-(5H-pyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;5-[5-(2,2,2-trifluoroethyl)pyrido[4,3-b]indol-7-yl]-1H-pyridin-2-one
CID 160586188
5-[5-(2,2-difluoroethyl)pyrido[4,3-b]indol-7-yl]-1H-pyridin-2-one;5-(8,9-difluoro-5-methylpyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;5-(4-fluoro-5-methylpyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;5-(8-fluoro-5-methylpyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;5-(9-fluoro-5-methylpyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;5-[5-(2,2,2-trifluoroethyl)pyrido[4,3-b]indol-7-yl]-1H-pyridin-2-one
CID 161606517
N-(2-amino-2-oxoethyl)-2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]acetamide;N-[2-(dimethylamino)ethyl]-2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]acetamide;N-(2-fluoroethyl)-2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(isocyanomethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-propylacetamide;oxalic acid;hydrate
CID 157762245
cyclopropyl-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]methanone;1-ethyl-4-[4-(6-fluoro-1H-indol-3-yl)piperidine-1-carbonyl]pyrrolidin-2-one;1-[4-[4-(6-fluoro-1H-indol-3-yl)piperidine-1-carbonyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-2-hydroxyethanone;1-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-2-methylpropan-1-one
CID 157866067
N-[[1-[1-[2-(2,4-difluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[4-(4-fluorophenyl)butyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]imidazolidine-2,4-dione;1-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]imidazolidin-2-one;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-methylpropanamide;1-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]pyrrolidin-2-one;methane;oxalic acid
CID 158305188
6-ethyl-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indole;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]butanamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]cyclopropanecarboxamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-N-methylacetamide;N-[[1-[1-[3-(4-fluorophenyl)propyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;oxalic acid
CID 158384794
N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;methyl N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]carbamate;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide
CID 158440334
N-(2-amino-2-oxoethyl)-2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]acetamide;N-[2-(dimethylamino)ethyl]-2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]acetamide;N-(2-fluoroethyl)-2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]acetamide;4-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]but-3-en-2-one;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(isocyanomethyl)acetamide;2-[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]-N-(2-methoxyethyl)acetamide;oxalic acid
CID 158537553
N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-[4-(1-hydroxyethyl)phenyl]ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;methyl N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]carbamate;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide
CID 158818509
8,9-difluoro-5-methyl-7-pyridin-3-ylpyrido[4,3-b]indole;5-[5-(2-fluoroethyl)pyrido[4,3-b]indol-7-yl]-1H-pyridin-2-one;8-fluoro-5-methyl-7-pyridin-3-ylpyrido[4,3-b]indole;9-fluoro-5-methyl-7-pyridin-3-ylpyrido[4,3-b]indole;5-(5-methylpyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one;5-(5H-pyrido[4,3-b]indol-7-yl)-1H-pyridin-2-one
CID 158843986

Frequently Asked Questions

What is the IUPAC name of N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide?
The IUPAC name of N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide (CID 158962644) is N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide.
What is the SMILES notation for N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide?
The canonical SMILES for N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide is CC(=O)NCc1ccc2c(C#N)cn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.CC(=O)NCc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.CC(=O)NCc1ccc2ccn(C3CCN(CCc4cccnc4)CC3)c2c1.CC(=O)NCc1ccc2ccn(C3CCNCC3)c2c1.CN(C)C(=O)NCc1ccc2ccn(C3CCN(CCc4ccc(F)cc4)CC3)c2c1.O=C(CO)NCc1ccc2ccn(C3CCN(CCc4ccccc4F)CC3)c2c1.
What is the InChIKey of N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide?
The InChIKey is JMUSDAZHPNOUJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H31FN4O.C25H27FN4O.C24H28FN3O2.C24H28FN3O.C23H28N4O.C16H21N3O/c1-28(2)25(31)27-18-20-3-6-21-10-16-30(24(21)17-20)23-11-14-29(15-12-23)13-9-19-4-7-22(26)8-5-19;1-18(31)28-16-20-4-7-24-21(15-27)17-30(25(24)14-20)23-9-12-29(13-10-23)11-8-19-2-5-22(26)6-3-19;25-22-4-2-1-3-19(22)7-11-27-12-9-21(10-13-27)28-14-8-20-6-5-18(15-23(20)28)16-26-24(30)17-29;1-18(29)26-17-20-2-5-21-9-15-28(24(21)16-20)23-10-13-27(14-11-23)12-8-19-3-6-22(25)7-4-19;1-18(28)25-17-20-4-5-21-7-14-27(23(21)15-20)22-8-12-26(13-9-22)11-6-19-3-2-10-24-16-19;1-12(20)18-11-13-2-3-14-6-9-19(16(14)10-13)15-4-7-17-8-5-15/h3-8,10,16-17,23H,9,11-15,18H2,1-2H3,(H,27,31);2-7,14,17,23H,8-13,16H2,1H3,(H,28,31);1-6,8,14-15,21,29H,7,9-13,16-17H2,(H,26,30);2-7,9,15-16,23H,8,10-14,17H2,1H3,(H,26,29);2-5,7,10,14-16,22H,6,8-9,11-13,17H2,1H3,(H,25,28);2-3,6,9-10,15,17H,4-5,7-8,11H2,1H3,(H,18,20).
What are the key properties of N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide?
N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide has a molecular weight of 2291.94 g/mol, XLogP of 21.92, 34 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-cyano-1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;N-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]acetamide;3-[[1-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-1,1-dimethylurea;N-[[1-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]indol-6-yl]methyl]-2-hydroxyacetamide;N-[(1-piperidin-4-ylindol-6-yl)methyl]acetamide;N-[[1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]indol-6-yl]methyl]acetamide is sourced from PubChem (CID 158962644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).