4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide

C154H164Cl2N24O12 — CID 159384183

IUPAC4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide
SMILESCC(=O)Nc1ccc2nc(-c3ccc(C(=O)NC4CCC(C)CC4)cc3)[nH]c2c1.CC1CCC(NC(=O)c2ccc(-c3nc4ccc(NC(=O)C5CCCC5)cc4[nH]3)cc2)CC1.CC1CCC(NC(=O)c2ccc(-c3nc4ccc(NC(=O)c5ccc(Cl)c(Cl)c5)cc4[nH]3)cc2)CC1.CC1CCC(NC(=O)c2ccc(-c3nc4ccc(NC(=O)c5ccccc5)cc4[nH]3)cc2)CC1.CNC(=O)c1ccc(-c2nc3ccc(NC(=O)C45CC6CC(CC(C6)C4)C5)cc3[nH]2)cc1.CNC(=O)c1ccc(-c2nc3ccc(NC(=O)C4CCCCC4)cc3[nH]2)cc1
InChIInChI=1S/C28H26Cl2N4O2.C28H28N4O2.C27H32N4O2.C26H28N4O2.C23H26N4O2.C22H24N4O2/c1-16-2-9-20(10-3-16)31-27(35)18-6-4-17(5-7-18)26-33-24-13-11-21(15-25(24)34-26)32-28(36)19-8-12-22(29)23(30)14-19;1-18-7-13-22(14-8-18)29-28(34)21-11-9-19(10-12-21)26-31-24-16-15-23(17-25(24)32-26)30-27(33)20-5-3-2-4-6-20;1-17-6-12-21(13-7-17)28-27(33)20-10-8-18(9-11-20)25-30-23-15-14-22(16-24(23)31-25)29-26(32)19-4-2-3-5-19;1-27-24(31)19-4-2-18(3-5-19)23-29-21-7-6-20(11-22(21)30-23)28-25(32)26-12-15-8-16(13-26)10-17(9-15)14-26;1-14-3-9-18(10-4-14)25-23(29)17-7-5-16(6-8-17)22-26-20-12-11-19(24-15(2)28)13-21(20)27-22;1-23-21(27)16-9-7-14(8-10-16)20-25-18-12-11-17(13-19(18)26-20)24-22(28)15-5-3-2-4-6-15/h4-8,11-16,20H,2-3,9-10H2,1H3,(H,31,35)(H,32,36)(H,33,34);2-6,9-12,15-18,22H,7-8,13-14H2,1H3,(H,29,34)(H,30,33)(H,31,32);8-11,14-17,19,21H,2-7,12-13H2,1H3,(H,28,33)(H,29,32)(H,30,31);2-7,11,15-17H,8-10,12-14H2,1H3,(H,27,31)(H,28,32)(H,29,30);5-8,11-14,18H,3-4,9-10H2,1-2H3,(H,24,28)(H,25,29)(H,26,27);7-13,15H,2-6H2,1H3,(H,23,27)(H,24,28)(H,25,26)
InChIKeyLLHDJKMEXVVFPB-UHFFFAOYSA-N
MW2614.07 g/mol
LogP31.90
Rot. Bonds27

About 4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide

4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide (PubChem CID 159384183) has the molecular formula C154H164Cl2N24O12 and a molecular weight of 2614.07 g/mol. Its IUPAC name is 4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide.

Molecular Properties

Compound Name4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide
PubChem CID159384183
Molecular FormulaC154H164Cl2N24O12
Molecular Weight2614.07 g/mol
Exact Mass2611.23
IUPAC Name4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide
SMILESCC(=O)Nc1ccc2nc(-c3ccc(C(=O)NC4CCC(C)CC4)cc3)[nH]c2c1.CC1CCC(NC(=O)c2ccc(-c3nc4ccc(NC(=O)C5CCCC5)cc4[nH]3)cc2)CC1.CC1CCC(NC(=O)c2ccc(-c3nc4ccc(NC(=O)c5ccc(Cl)c(Cl)c5)cc4[nH]3)cc2)CC1.CC1CCC(NC(=O)c2ccc(-c3nc4ccc(NC(=O)c5ccccc5)cc4[nH]3)cc2)CC1.CNC(=O)c1ccc(-c2nc3ccc(NC(=O)C45CC6CC(CC(C6)C4)C5)cc3[nH]2)cc1.CNC(=O)c1ccc(-c2nc3ccc(NC(=O)C4CCCCC4)cc3[nH]2)cc1
InChIInChI=1S/C28H26Cl2N4O2.C28H28N4O2.C27H32N4O2.C26H28N4O2.C23H26N4O2.C22H24N4O2/c1-16-2-9-20(10-3-16)31-27(35)18-6-4-17(5-7-18)26-33-24-13-11-21(15-25(24)34-26)32-28(36)19-8-12-22(29)23(30)14-19;1-18-7-13-22(14-8-18)29-28(34)21-11-9-19(10-12-21)26-31-24-16-15-23(17-25(24)32-26)30-27(33)20-5-3-2-4-6-20;1-17-6-12-21(13-7-17)28-27(33)20-10-8-18(9-11-20)25-30-23-15-14-22(16-24(23)31-25)29-26(32)19-4-2-3-5-19;1-27-24(31)19-4-2-18(3-5-19)23-29-21-7-6-20(11-22(21)30-23)28-25(32)26-12-15-8-16(13-26)10-17(9-15)14-26;1-14-3-9-18(10-4-14)25-23(29)17-7-5-16(6-8-17)22-26-20-12-11-19(24-15(2)28)13-21(20)27-22;1-23-21(27)16-9-7-14(8-10-16)20-25-18-12-11-17(13-19(18)26-20)24-22(28)15-5-3-2-4-6-15/h4-8,11-16,20H,2-3,9-10H2,1H3,(H,31,35)(H,32,36)(H,33,34);2-6,9-12,15-18,22H,7-8,13-14H2,1H3,(H,29,34)(H,30,33)(H,31,32);8-11,14-17,19,21H,2-7,12-13H2,1H3,(H,28,33)(H,29,32)(H,30,31);2-7,11,15-17H,8-10,12-14H2,1H3,(H,27,31)(H,28,32)(H,29,30);5-8,11-14,18H,3-4,9-10H2,1-2H3,(H,24,28)(H,25,29)(H,26,27);7-13,15H,2-6H2,1H3,(H,23,27)(H,24,28)(H,25,26)
InChIKeyLLHDJKMEXVVFPB-UHFFFAOYSA-N
XLogP31.90
TPSA521.28 Ų
H-Bond Donors18
H-Bond Acceptors18
Rotatable Bonds27
Heavy Atoms192
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002614.07
LogP ≤ 531.90
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1018

Analyze 4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide?
The IUPAC name of 4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide (CID 159384183) is 4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide.
What is the SMILES notation for 4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide?
The canonical SMILES for 4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide is CC(=O)Nc1ccc2nc(-c3ccc(C(=O)NC4CCC(C)CC4)cc3)[nH]c2c1.CC1CCC(NC(=O)c2ccc(-c3nc4ccc(NC(=O)C5CCCC5)cc4[nH]3)cc2)CC1.CC1CCC(NC(=O)c2ccc(-c3nc4ccc(NC(=O)c5ccc(Cl)c(Cl)c5)cc4[nH]3)cc2)CC1.CC1CCC(NC(=O)c2ccc(-c3nc4ccc(NC(=O)c5ccccc5)cc4[nH]3)cc2)CC1.CNC(=O)c1ccc(-c2nc3ccc(NC(=O)C45CC6CC(CC(C6)C4)C5)cc3[nH]2)cc1.CNC(=O)c1ccc(-c2nc3ccc(NC(=O)C4CCCCC4)cc3[nH]2)cc1.
What is the InChIKey of 4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide?
The InChIKey is LLHDJKMEXVVFPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26Cl2N4O2.C28H28N4O2.C27H32N4O2.C26H28N4O2.C23H26N4O2.C22H24N4O2/c1-16-2-9-20(10-3-16)31-27(35)18-6-4-17(5-7-18)26-33-24-13-11-21(15-25(24)34-26)32-28(36)19-8-12-22(29)23(30)14-19;1-18-7-13-22(14-8-18)29-28(34)21-11-9-19(10-12-21)26-31-24-16-15-23(17-25(24)32-26)30-27(33)20-5-3-2-4-6-20;1-17-6-12-21(13-7-17)28-27(33)20-10-8-18(9-11-20)25-30-23-15-14-22(16-24(23)31-25)29-26(32)19-4-2-3-5-19;1-27-24(31)19-4-2-18(3-5-19)23-29-21-7-6-20(11-22(21)30-23)28-25(32)26-12-15-8-16(13-26)10-17(9-15)14-26;1-14-3-9-18(10-4-14)25-23(29)17-7-5-16(6-8-17)22-26-20-12-11-19(24-15(2)28)13-21(20)27-22;1-23-21(27)16-9-7-14(8-10-16)20-25-18-12-11-17(13-19(18)26-20)24-22(28)15-5-3-2-4-6-15/h4-8,11-16,20H,2-3,9-10H2,1H3,(H,31,35)(H,32,36)(H,33,34);2-6,9-12,15-18,22H,7-8,13-14H2,1H3,(H,29,34)(H,30,33)(H,31,32);8-11,14-17,19,21H,2-7,12-13H2,1H3,(H,28,33)(H,29,32)(H,30,31);2-7,11,15-17H,8-10,12-14H2,1H3,(H,27,31)(H,28,32)(H,29,30);5-8,11-14,18H,3-4,9-10H2,1-2H3,(H,24,28)(H,25,29)(H,26,27);7-13,15H,2-6H2,1H3,(H,23,27)(H,24,28)(H,25,26).
What are the key properties of 4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide?
4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide has a molecular weight of 2614.07 g/mol, XLogP of 31.90, 27 rotatable bonds, 18 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-acetamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-(6-benzamido-1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)benzamide;4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-2-yl]-N-methylbenzamide;4-[6-(cyclopentanecarbonylamino)-1H-benzimidazol-2-yl]-N-(4-methylcyclohexyl)benzamide;3,4-dichloro-N-[2-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]-3H-benzimidazol-5-yl]benzamide;N-[2-[4-(methylcarbamoyl)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide is sourced from PubChem (CID 159384183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).