[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone

C147H179Cl2N27O6 — CID 157489709

IUPAC[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone
SMILESCN(C)CCN(C)C(=O)C1CCCN(c2cccc(-c3nc4ccccc4n3C)c2)C1.CN(C)CCNC(=O)C1CCCN(c2cccc(-c3nc4ccccc4n3C)c2)C1.CN1CCCN(C(=O)C2CCCN(c3cccc(-c4nc5ccccc5n4C)c3)C2)CC1.Cn1c(-c2cccc(N3CCCC(C(=O)N4CCCCC4)C3)c2)nc2ccccc21.O=C(C1CCCN(c2ccc(Cl)c(-c3nc4ccccc4[nH]3)c2)C1)N1CCCC1.O=C(C1CCCN(c2ccc(Cl)c(-c3nc4ccccc4[nH]3)c2)C1)N1CCCCC1
InChIInChI=1S/C26H33N5O.C25H33N5O.C25H30N4O.C24H27ClN4O.C24H31N5O.C23H25ClN4O/c1-28-13-7-15-30(17-16-28)26(32)21-9-6-14-31(19-21)22-10-5-8-20(18-22)25-27-23-11-3-4-12-24(23)29(25)2;1-27(2)15-16-28(3)25(31)20-10-8-14-30(18-20)21-11-7-9-19(17-21)24-26-22-12-5-6-13-23(22)29(24)4;1-27-23-13-4-3-12-22(23)26-24(27)19-9-7-11-21(17-19)29-16-8-10-20(18-29)25(30)28-14-5-2-6-15-28;25-20-11-10-18(15-19(20)23-26-21-8-2-3-9-22(21)27-23)29-14-6-7-17(16-29)24(30)28-12-4-1-5-13-28;1-27(2)15-13-25-24(30)19-9-7-14-29(17-19)20-10-6-8-18(16-20)23-26-21-11-4-5-12-22(21)28(23)3;24-19-10-9-17(14-18(19)22-25-20-7-1-2-8-21(20)26-22)28-13-5-6-16(15-28)23(29)27-11-3-4-12-27/h3-5,8,10-12,18,21H,6-7,9,13-17,19H2,1-2H3;5-7,9,11-13,17,20H,8,10,14-16,18H2,1-4H3;3-4,7,9,11-13,17,20H,2,5-6,8,10,14-16,18H2,1H3;2-3,8-11,15,17H,1,4-7,12-14,16H2,(H,26,27);4-6,8,10-12,16,19H,7,9,13-15,17H2,1-3H3,(H,25,30);1-2,7-10,14,16H,3-6,11-13,15H2,(H,25,26)
InChIKeyBXCYGCHJUIDHCZ-UHFFFAOYSA-N
MW2491.14 g/mol
LogP24.54
Rot. Bonds24

About [1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone

[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone (PubChem CID 157489709) has the molecular formula C147H179Cl2N27O6 and a molecular weight of 2491.14 g/mol. Its IUPAC name is [1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone
PubChem CID157489709
Molecular FormulaC147H179Cl2N27O6
Molecular Weight2491.14 g/mol
Exact Mass2488.39
IUPAC Name[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone
SMILESCN(C)CCN(C)C(=O)C1CCCN(c2cccc(-c3nc4ccccc4n3C)c2)C1.CN(C)CCNC(=O)C1CCCN(c2cccc(-c3nc4ccccc4n3C)c2)C1.CN1CCCN(C(=O)C2CCCN(c3cccc(-c4nc5ccccc5n4C)c3)C2)CC1.Cn1c(-c2cccc(N3CCCC(C(=O)N4CCCCC4)C3)c2)nc2ccccc21.O=C(C1CCCN(c2ccc(Cl)c(-c3nc4ccccc4[nH]3)c2)C1)N1CCCC1.O=C(C1CCCN(c2ccc(Cl)c(-c3nc4ccccc4[nH]3)c2)C1)N1CCCCC1
InChIInChI=1S/C26H33N5O.C25H33N5O.C25H30N4O.C24H27ClN4O.C24H31N5O.C23H25ClN4O/c1-28-13-7-15-30(17-16-28)26(32)21-9-6-14-31(19-21)22-10-5-8-20(18-22)25-27-23-11-3-4-12-24(23)29(25)2;1-27(2)15-16-28(3)25(31)20-10-8-14-30(18-20)21-11-7-9-19(17-21)24-26-22-12-5-6-13-23(22)29(24)4;1-27-23-13-4-3-12-22(23)26-24(27)19-9-7-11-21(17-19)29-16-8-10-20(18-29)25(30)28-14-5-2-6-15-28;25-20-11-10-18(15-19(20)23-26-21-8-2-3-9-22(21)27-23)29-14-6-7-17(16-29)24(30)28-12-4-1-5-13-28;1-27(2)15-13-25-24(30)19-9-7-14-29(17-19)20-10-6-8-18(16-20)23-26-21-11-4-5-12-22(21)28(23)3;24-19-10-9-17(14-18(19)22-25-20-7-1-2-8-21(20)26-22)28-13-5-6-16(15-28)23(29)27-11-3-4-12-27/h3-5,8,10-12,18,21H,6-7,9,13-17,19H2,1-2H3;5-7,9,11-13,17,20H,8,10,14-16,18H2,1-4H3;3-4,7,9,11-13,17,20H,2,5-6,8,10,14-16,18H2,1H3;2-3,8-11,15,17H,1,4-7,12-14,16H2,(H,26,27);4-6,8,10-12,16,19H,7,9,13-15,17H2,1-3H3,(H,25,30);1-2,7-10,14,16H,3-6,11-13,15H2,(H,25,26)
InChIKeyBXCYGCHJUIDHCZ-UHFFFAOYSA-N
XLogP24.54
TPSA288.45 Ų
H-Bond Donors3
H-Bond Acceptors25
Rotatable Bonds24
Heavy Atoms182
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002491.14
LogP ≤ 524.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1025

Analyze [1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone with MolForge

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Related Compounds

N-[3-(6-acetamido-1H-benzimidazol-2-yl)-4-chlorophenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;tert-butyl 4-[[2-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]benzimidazol-1-yl]methyl]piperidine-1-carboxylate;N-[4-chloro-3-(1-methylbenzimidazol-2-yl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-[1-(piperidin-4-ylmethyl)benzimidazol-2-yl]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 157748484
tert-butyl 4-[[2-[2-chloro-5-[[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]benzimidazol-1-yl]methyl]piperidine-1-carboxylate;bis(N-[4-chloro-3-[1-(piperidin-4-ylmethyl)benzimidazol-2-yl]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide)
CID 159529470
[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]pyrrolidin-3-yl]-[3-(dimethylamino)pyrrolidin-1-yl]methanone;[(3S)-1-[4-chloro-3-(6-methyl-1H-benzimidazol-2-yl)phenyl]piperidin-3-yl]-morpholin-4-ylmethanone
CID 67128004
[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]pyrrolidin-3-yl]-[3-(dimethylamino)pyrrolidin-1-yl]methanone;[1-[4-chloro-3-(6-methyl-1H-benzimidazol-2-yl)phenyl]piperidin-3-yl]-morpholin-4-ylmethanone
CID 67128005
(2S)-N-[(4-amino-1H-imidazo[4,5-c]pyridin-2-yl)methyl]-1-[(2,4-dichlorophenyl)methyl]pyrrolidine-2-carboxamide;(2S)-N-(1H-benzimidazol-2-ylmethyl)-1-[(2,4-dichlorophenyl)methyl]pyrrolidine-2-carboxamide;(2S)-1-[(2,4-dichlorophenyl)methyl]-N-(3H-imidazo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;(2S)-1-[(2,4-dichlorophenyl)methyl]-N-(7H-purin-8-ylmethyl)pyrrolidine-2-carboxamide
CID 90901549
carbon dioxide;[4-[1-[(3-chlorophenyl)methyl]-2-methylbenzimidazole-5-carbonyl]piperazin-1-yl]-cyclohexylmethanone;2,5-dimethyl-1-(3-methylphenyl)benzimidazole;[2-methyl-1-[(4-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;[2-methyl-3-[(3-methylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone;(2-methyl-1-phenyl-3H-benzimidazol-1-ium-5-yl)-piperidin-1-ylmethanone;[2-methyl-1-[(3-piperidin-1-ylphenyl)methyl]benzimidazol-5-yl]-piperidin-1-ylmethanone
CID 157064112
N-(2-aminoethyl)acetamide;N-[2-[[6-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl]acetamide;4-chloro-7-methyl-2-phenyl-6-[(E)-prop-1-enyl]pyrrolo[2,3-d]pyrimidine;4-chloro-7-methyl-2-phenyl-6-propylpyrrolo[2,3-d]pyrimidine;N-[2-[(2-phenyl-6-propyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]acetamide;prop-1-ene;tritium monohydride;hydrofluoride
CID 157094699
3-(1H-benzimidazol-2-yl)-1-[1-[(5-chloro-1H-indol-3-yl)methyl]piperidin-4-yl]butan-1-one;3-(1H-benzimidazol-2-yl)-1-[1-[(5-fluoro-1H-indol-3-yl)methyl]piperidin-4-yl]butan-1-one;3-(1H-benzimidazol-2-yl)-1-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]butan-1-one;N-(1H-benzimidazol-2-ylmethyl)-1-(1H-indol-3-ylmethyl)-N-methylpiperidine-4-carboxamide;1-[1-[(5-chloro-1H-indol-3-yl)methyl]piperidin-4-yl]-3-(6-fluoro-1H-benzimidazol-2-yl)propan-1-one;3-(5,6-difluoro-1H-benzimidazol-2-yl)-1-[1-[(5-fluoro-1H-indol-3-yl)methyl]piperidin-4-yl]propan-1-one;3-(5,6-difluoro-1H-benzimidazol-2-yl)-1-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]propan-1-one;3-(6-fluoro-1H-benzimidazol-2-yl)-1-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]propan-1-one
CID 157660410
[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-4-yl]-(4-methylpiperazin-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-4-yl]-(4-methylpiperazin-1-yl)methanone
CID 157740829
[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-[4-(2-chlorophenyl)phenyl]methanone;[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-[4-(3-chlorophenyl)phenyl]methanone;[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-[4-(4-chlorophenyl)phenyl]methanone;[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-[4-(2-fluorophenyl)phenyl]methanone;[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-[4-(3-fluorophenyl)phenyl]methanone;[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-[4-(4-fluorophenyl)phenyl]methanone;[4-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]-(4-phenylphenyl)methanone
CID 157772753
1,4-bis(bromomethyl)benzene;1-[4-[1-[[4-(bromomethyl)phenyl]methyl]-5,6-dichlorobenzimidazol-2-yl]piperidin-1-yl]ethanone;1-[4-(5,6-dichloro-1H-benzimidazol-2-yl)piperidin-1-yl]ethanone;1-[4-[5,6-dichloro-1-[(4-ethylphenyl)methyl]benzimidazol-2-yl]piperidin-1-yl]ethanone;5,6-dichloro-1-[(4-ethylphenyl)methyl]-2-piperidin-4-ylbenzimidazole;N'-methylethane-1,2-diamine;1-methylpiperazine;1-methylpiperidin-3-amine;1-methylpiperidin-4-amine;[(2S)-1-methylpyrrolidin-2-yl]methanamine
CID 157867758
tris(5-[2-(5-chloro-6-methyl-1H-benzimidazol-2-yl)ethyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one);bis(5-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one);bis(5-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one)
CID 158081718

Frequently Asked Questions

What is the IUPAC name of [1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone?
The IUPAC name of [1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone (CID 157489709) is [1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone.
What is the SMILES notation for [1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone?
The canonical SMILES for [1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone is CN(C)CCN(C)C(=O)C1CCCN(c2cccc(-c3nc4ccccc4n3C)c2)C1.CN(C)CCNC(=O)C1CCCN(c2cccc(-c3nc4ccccc4n3C)c2)C1.CN1CCCN(C(=O)C2CCCN(c3cccc(-c4nc5ccccc5n4C)c3)C2)CC1.Cn1c(-c2cccc(N3CCCC(C(=O)N4CCCCC4)C3)c2)nc2ccccc21.O=C(C1CCCN(c2ccc(Cl)c(-c3nc4ccccc4[nH]3)c2)C1)N1CCCC1.O=C(C1CCCN(c2ccc(Cl)c(-c3nc4ccccc4[nH]3)c2)C1)N1CCCCC1.
What is the InChIKey of [1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone?
The InChIKey is BXCYGCHJUIDHCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N5O.C25H33N5O.C25H30N4O.C24H27ClN4O.C24H31N5O.C23H25ClN4O/c1-28-13-7-15-30(17-16-28)26(32)21-9-6-14-31(19-21)22-10-5-8-20(18-22)25-27-23-11-3-4-12-24(23)29(25)2;1-27(2)15-16-28(3)25(31)20-10-8-14-30(18-20)21-11-7-9-19(17-21)24-26-22-12-5-6-13-23(22)29(24)4;1-27-23-13-4-3-12-22(23)26-24(27)19-9-7-11-21(17-19)29-16-8-10-20(18-29)25(30)28-14-5-2-6-15-28;25-20-11-10-18(15-19(20)23-26-21-8-2-3-9-22(21)27-23)29-14-6-7-17(16-29)24(30)28-12-4-1-5-13-28;1-27(2)15-13-25-24(30)19-9-7-14-29(17-19)20-10-6-8-18(16-20)23-26-21-11-4-5-12-22(21)28(23)3;24-19-10-9-17(14-18(19)22-25-20-7-1-2-8-21(20)26-22)28-13-5-6-16(15-28)23(29)27-11-3-4-12-27/h3-5,8,10-12,18,21H,6-7,9,13-17,19H2,1-2H3;5-7,9,11-13,17,20H,8,10,14-16,18H2,1-4H3;3-4,7,9,11-13,17,20H,2,5-6,8,10,14-16,18H2,1H3;2-3,8-11,15,17H,1,4-7,12-14,16H2,(H,26,27);4-6,8,10-12,16,19H,7,9,13-15,17H2,1-3H3,(H,25,30);1-2,7-10,14,16H,3-6,11-13,15H2,(H,25,26).
What are the key properties of [1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone?
[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone has a molecular weight of 2491.14 g/mol, XLogP of 24.54, 24 rotatable bonds, 3 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-piperidin-1-ylmethanone;[1-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone;N-[2-(dimethylamino)ethyl]-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;N-[2-(dimethylamino)ethyl]-N-methyl-1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone;[1-[3-(1-methylbenzimidazol-2-yl)phenyl]piperidin-3-yl]-piperidin-1-ylmethanone is sourced from PubChem (CID 157489709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).