N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide

C222H243N35O16 — CID 158353321

IUPACN-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide
SMILESCC1CCC(NC(=O)c2ccc(-c3nc4ccc(C(=O)NC5C6CC7CC(C6)CC5C7)cc4[nH]3)cc2)CC1.CC1CCC(NC(=O)c2ccc(-c3nc4ccc(C(=O)NC5CCCCC5)cc4[nH]3)cc2)CC1.CC1CCCCC1NC(=O)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.Cc1ccc(NC(=O)c2ccc(-c3nc4ccc(C(=O)NC5CCCCC5)cc4[nH]3)cc2)nc1.O=C(NC1CCCCCC1)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.O=C(Nc1ccccc1)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.O=C(Nc1cccnc1)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.O=C(Nc1ccncc1)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1
InChIInChI=1S/C32H38N4O2.3C28H34N4O2.C27H27N5O2.C27H26N4O2.2C26H25N5O2/c1-18-2-9-26(10-3-18)33-31(37)22-6-4-21(5-7-22)30-34-27-11-8-23(17-28(27)35-30)32(38)36-29-24-13-19-12-20(15-24)16-25(29)14-19;1-18-7-5-6-10-23(18)32-27(33)20-13-11-19(12-14-20)26-30-24-16-15-21(17-25(24)31-26)28(34)29-22-8-3-2-4-9-22;1-18-7-14-23(15-8-18)30-27(33)20-11-9-19(10-12-20)26-31-24-16-13-21(17-25(24)32-26)28(34)29-22-5-3-2-4-6-22;33-27(29-22-8-4-1-2-5-9-22)20-14-12-19(13-15-20)26-31-24-17-16-21(18-25(24)32-26)28(34)30-23-10-6-3-7-11-23;1-17-7-14-24(28-16-17)32-26(33)19-10-8-18(9-11-19)25-30-22-13-12-20(15-23(22)31-25)27(34)29-21-5-3-2-4-6-21;32-26(28-21-7-3-1-4-8-21)19-13-11-18(12-14-19)25-30-23-16-15-20(17-24(23)31-25)27(33)29-22-9-5-2-6-10-22;32-25(29-21-7-4-14-27-16-21)18-10-8-17(9-11-18)24-30-22-13-12-19(15-23(22)31-24)26(33)28-20-5-2-1-3-6-20;32-25(29-21-12-14-27-15-13-21)18-8-6-17(7-9-18)24-30-22-11-10-19(16-23(22)31-24)26(33)28-20-4-2-1-3-5-20/h4-8,11,17-20,24-26,29H,2-3,9-10,12-16H2,1H3,(H,33,37)(H,34,35)(H,36,38);11-18,22-23H,2-10H2,1H3,(H,29,34)(H,30,31)(H,32,33);9-13,16-18,22-23H,2-8,14-15H2,1H3,(H,29,34)(H,30,33)(H,31,32);12-18,22-23H,1-11H2,(H,29,33)(H,30,34)(H,31,32);7-16,21H,2-6H2,1H3,(H,29,34)(H,30,31)(H,28,32,33);1,3-4,7-8,11-17,22H,2,5-6,9-10H2,(H,28,32)(H,29,33)(H,30,31);4,7-16,20H,1-3,5-6H2,(H,28,33)(H,29,32)(H,30,31);6-16,20H,1-5H2,(H,28,33)(H,30,31)(H,27,29,32)
InChIKeyGSOSMJGPCIVSBH-UHFFFAOYSA-N
MW3657.61 g/mol
LogP43.71
Rot. Bonds40

About N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide

N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide (PubChem CID 158353321) has the molecular formula C222H243N35O16 and a molecular weight of 3657.61 g/mol. Its IUPAC name is N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide
PubChem CID158353321
Molecular FormulaC222H243N35O16
Molecular Weight3657.61 g/mol
Exact Mass3654.93
IUPAC NameN-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide
SMILESCC1CCC(NC(=O)c2ccc(-c3nc4ccc(C(=O)NC5C6CC7CC(C6)CC5C7)cc4[nH]3)cc2)CC1.CC1CCC(NC(=O)c2ccc(-c3nc4ccc(C(=O)NC5CCCCC5)cc4[nH]3)cc2)CC1.CC1CCCCC1NC(=O)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.Cc1ccc(NC(=O)c2ccc(-c3nc4ccc(C(=O)NC5CCCCC5)cc4[nH]3)cc2)nc1.O=C(NC1CCCCCC1)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.O=C(Nc1ccccc1)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.O=C(Nc1cccnc1)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.O=C(Nc1ccncc1)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1
InChIInChI=1S/C32H38N4O2.3C28H34N4O2.C27H27N5O2.C27H26N4O2.2C26H25N5O2/c1-18-2-9-26(10-3-18)33-31(37)22-6-4-21(5-7-22)30-34-27-11-8-23(17-28(27)35-30)32(38)36-29-24-13-19-12-20(15-24)16-25(29)14-19;1-18-7-5-6-10-23(18)32-27(33)20-13-11-19(12-14-20)26-30-24-16-15-21(17-25(24)31-26)28(34)29-22-8-3-2-4-9-22;1-18-7-14-23(15-8-18)30-27(33)20-11-9-19(10-12-20)26-31-24-16-13-21(17-25(24)32-26)28(34)29-22-5-3-2-4-6-22;33-27(29-22-8-4-1-2-5-9-22)20-14-12-19(13-15-20)26-31-24-17-16-21(18-25(24)32-26)28(34)30-23-10-6-3-7-11-23;1-17-7-14-24(28-16-17)32-26(33)19-10-8-18(9-11-19)25-30-22-13-12-20(15-23(22)31-25)27(34)29-21-5-3-2-4-6-21;32-26(28-21-7-3-1-4-8-21)19-13-11-18(12-14-19)25-30-23-16-15-20(17-24(23)31-25)27(33)29-22-9-5-2-6-10-22;32-25(29-21-7-4-14-27-16-21)18-10-8-17(9-11-18)24-30-22-13-12-19(15-23(22)31-24)26(33)28-20-5-2-1-3-6-20;32-25(29-21-12-14-27-15-13-21)18-8-6-17(7-9-18)24-30-22-11-10-19(16-23(22)31-24)26(33)28-20-4-2-1-3-5-20/h4-8,11,17-20,24-26,29H,2-3,9-10,12-16H2,1H3,(H,33,37)(H,34,35)(H,36,38);11-18,22-23H,2-10H2,1H3,(H,29,34)(H,30,31)(H,32,33);9-13,16-18,22-23H,2-8,14-15H2,1H3,(H,29,34)(H,30,33)(H,31,32);12-18,22-23H,1-11H2,(H,29,33)(H,30,34)(H,31,32);7-16,21H,2-6H2,1H3,(H,29,34)(H,30,31)(H,28,32,33);1,3-4,7-8,11-17,22H,2,5-6,9-10H2,(H,28,32)(H,29,33)(H,30,31);4,7-16,20H,1-3,5-6H2,(H,28,33)(H,29,32)(H,30,31);6-16,20H,1-5H2,(H,28,33)(H,30,31)(H,27,29,32)
InChIKeyGSOSMJGPCIVSBH-UHFFFAOYSA-N
XLogP43.71
TPSA733.71 Ų
H-Bond Donors24
H-Bond Acceptors27
Rotatable Bonds40
Heavy Atoms273
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003657.61
LogP ≤ 543.71
H-Bond Donors ≤ 524
H-Bond Acceptors ≤ 1027

Analyze N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide with MolForge

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Related Compounds

4-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-acetamido-3-(1H-imidazol-4-yl)propanoyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-N-[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]benzamide
CID 44308543
4-[[4-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-acetamido-3-(1H-imidazol-4-yl)propanoyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]benzoyl]amino]-N-[4-[[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]carbamoyl]phenyl]benzamide
CID 44387457
4-[[4-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-acetamido-3-(1H-imidazol-4-yl)propanoyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]benzoyl]amino]-N-[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]benzamide
CID 44387459
N,N'-bis[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methyl]tridecanediamide
CID 145970174
8-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-methylpentanoyl]amino]hexanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-phenylpropanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-phenylpropanoyl]amino]-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]octanamide
CID 52945811
H-Phe-Ile-Lys-His-Phe-Ile-His-Arg-Phe-Gly-Gly-Gly-Arg-Trp-Arg-Trp-Arg-Trp-Phe-NH2
CID 52948233
[2-[[ethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]-3H-benzimidazol-5-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 91800765
N,N'-bis[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methyl]undecanediamide
CID 145968592
N,N'-bis[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methyl]nonanediamide
CID 145970833
N-[3-(dimethylamino)propyl]-2-[2-[[[2-[4-[2-[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methylamino]-2-oxoethyl]piperazin-1-yl]acetyl]amino]methyl]-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxamide
CID 156015028
N-[3-(dimethylamino)propyl]-2-[2-[[3-[4-[3-[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methylamino]-3-oxopropyl]piperazin-1-yl]propanoylamino]methyl]-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxamide
CID 156020974
N-[3-(dimethylamino)propyl]-2-[2-[[4-[4-[4-[[6-[6-[3-(dimethylamino)propylcarbamoyl]-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]methylamino]-4-oxobutyl]piperazin-1-yl]butanoylamino]methyl]-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxamide
CID 156021008

Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide?
The IUPAC name of N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide (CID 158353321) is N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide?
The canonical SMILES for N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide is CC1CCC(NC(=O)c2ccc(-c3nc4ccc(C(=O)NC5C6CC7CC(C6)CC5C7)cc4[nH]3)cc2)CC1.CC1CCC(NC(=O)c2ccc(-c3nc4ccc(C(=O)NC5CCCCC5)cc4[nH]3)cc2)CC1.CC1CCCCC1NC(=O)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.Cc1ccc(NC(=O)c2ccc(-c3nc4ccc(C(=O)NC5CCCCC5)cc4[nH]3)cc2)nc1.O=C(NC1CCCCCC1)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.O=C(Nc1ccccc1)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.O=C(Nc1cccnc1)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.O=C(Nc1ccncc1)c1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1.
What is the InChIKey of N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide?
The InChIKey is GSOSMJGPCIVSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H38N4O2.3C28H34N4O2.C27H27N5O2.C27H26N4O2.2C26H25N5O2/c1-18-2-9-26(10-3-18)33-31(37)22-6-4-21(5-7-22)30-34-27-11-8-23(17-28(27)35-30)32(38)36-29-24-13-19-12-20(15-24)16-25(29)14-19;1-18-7-5-6-10-23(18)32-27(33)20-13-11-19(12-14-20)26-30-24-16-15-21(17-25(24)31-26)28(34)29-22-8-3-2-4-9-22;1-18-7-14-23(15-8-18)30-27(33)20-11-9-19(10-12-20)26-31-24-16-13-21(17-25(24)32-26)28(34)29-22-5-3-2-4-6-22;33-27(29-22-8-4-1-2-5-9-22)20-14-12-19(13-15-20)26-31-24-17-16-21(18-25(24)32-26)28(34)30-23-10-6-3-7-11-23;1-17-7-14-24(28-16-17)32-26(33)19-10-8-18(9-11-19)25-30-22-13-12-20(15-23(22)31-25)27(34)29-21-5-3-2-4-6-21;32-26(28-21-7-3-1-4-8-21)19-13-11-18(12-14-19)25-30-23-16-15-20(17-24(23)31-25)27(33)29-22-9-5-2-6-10-22;32-25(29-21-7-4-14-27-16-21)18-10-8-17(9-11-18)24-30-22-13-12-19(15-23(22)31-24)26(33)28-20-5-2-1-3-6-20;32-25(29-21-12-14-27-15-13-21)18-8-6-17(7-9-18)24-30-22-11-10-19(16-23(22)31-24)26(33)28-20-4-2-1-3-5-20/h4-8,11,17-20,24-26,29H,2-3,9-10,12-16H2,1H3,(H,33,37)(H,34,35)(H,36,38);11-18,22-23H,2-10H2,1H3,(H,29,34)(H,30,31)(H,32,33);9-13,16-18,22-23H,2-8,14-15H2,1H3,(H,29,34)(H,30,33)(H,31,32);12-18,22-23H,1-11H2,(H,29,33)(H,30,34)(H,31,32);7-16,21H,2-6H2,1H3,(H,29,34)(H,30,31)(H,28,32,33);1,3-4,7-8,11-17,22H,2,5-6,9-10H2,(H,28,32)(H,29,33)(H,30,31);4,7-16,20H,1-3,5-6H2,(H,28,33)(H,29,32)(H,30,31);6-16,20H,1-5H2,(H,28,33)(H,30,31)(H,27,29,32).
What are the key properties of N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide?
N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide has a molecular weight of 3657.61 g/mol, XLogP of 43.71, 40 rotatable bonds, 24 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptylcarbamoyl)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(2-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(phenylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 158353321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).