3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide

C144H161BrCl8N18O6 — CID 158634065

About 3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide

3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide (PubChem CID 158634065) has the molecular formula C144H161BrCl8N18O6 and a molecular weight of 2603.52 g/mol. Its IUPAC name is 3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide.

Molecular Properties

• Compound Name: 3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide
• PubChem CID: 158634065
• Molecular Formula: C144H161BrCl8N18O6
• Molecular Weight: 2603.52 g/mol
• Exact Mass: 2596.95
• IUPAC Name: 3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide
• SMILES: C=CCn1c(CN(C(=O)c2ccc(CCCCC)cc2)C2CCCC2)nc2ccccc21.C=CCn1c(CN(C(=O)c2ccc(Cl)cc2Cl)C2CCCC2)nc2ccccc21.C=CCn1c(CN(CC(C)C)C(=O)c2ccc(Cl)c(Cl)c2)nc2ccccc21.C=CCn1c(CN(CCC(C)C)C(=O)c2cc(Cl)ccc2Cl)nc2ccccc21.C=CCn1c(CN(CCC(C)C)C(=O)c2cccc(Br)c2)nc2ccccc21.CC(C)CCN(Cc1nc2ccc(Cl)cc2n1C1CCCC1)C(=O)c1ccccc1Cl
• InChI: InChI=1S/C28H35N3O.C25H29Cl2N3O.C23H26BrN3O.C23H23Cl2N3O.C23H25Cl2N3O.C22H23Cl2N3O/c1-3-5-6-11-22-16-18-23(19-17-22)28(32)31(24-12-7-8-13-24)21-27-29-25-14-9-10-15-26(25)30(27)20-4-2;1-17(2)13-14-29(25(31)20-9-5-6-10-21(20)27)16-24-28-22-12-11-18(26)15-23(22)30(24)19-7-3-4-8-19;1-4-13-27-21-11-6-5-10-20(21)25-22(27)16-26(14-12-17(2)3)23(28)18-8-7-9-19(24)15-18;1-2-13-27-21-10-6-5-9-20(21)26-22(27)15-28(17-7-3-4-8-17)23(29)18-12-11-16(24)14-19(18)25;1-4-12-28-21-8-6-5-7-20(21)26-22(28)15-27(13-11-16(2)3)23(29)18-14-17(24)9-10-19(18)25;1-4-11-27-20-8-6-5-7-19(20)25-21(27)14-26(13-15(2)3)22(28)16-9-10-17(23)18(24)12-16/h4,9-10,14-19,24H,2-3,5-8,11-13,20-21H2,1H3;5-6,9-12,15,17,19H,3-4,7-8,13-14,16H2,1-2H3;4-11,15,17H,1,12-14,16H2,2-3H3;2,5-6,9-12,14,17H,1,3-4,7-8,13,15H2;4-10,14,16H,1,11-13,15H2,2-3H3;4-10,12,15H,1,11,13-14H2,2-3H3
• InChIKey: HZNZJBHNKWDBKC-UHFFFAOYSA-N
• XLogP: 37.52
• TPSA: 228.78 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 46
• Heavy Atoms: 177
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2603.52
LogP ≤ 5	37.52
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide?

The IUPAC name of 3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide (CID 158634065) is 3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide.

What is the SMILES notation for 3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide?

The canonical SMILES for 3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide is C=CCn1c(CN(C(=O)c2ccc(CCCCC)cc2)C2CCCC2)nc2ccccc21.C=CCn1c(CN(C(=O)c2ccc(Cl)cc2Cl)C2CCCC2)nc2ccccc21.C=CCn1c(CN(CC(C)C)C(=O)c2ccc(Cl)c(Cl)c2)nc2ccccc21.C=CCn1c(CN(CCC(C)C)C(=O)c2cc(Cl)ccc2Cl)nc2ccccc21.C=CCn1c(CN(CCC(C)C)C(=O)c2cccc(Br)c2)nc2ccccc21.CC(C)CCN(Cc1nc2ccc(Cl)cc2n1C1CCCC1)C(=O)c1ccccc1Cl.

What is the InChIKey of 3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide?

The InChIKey is HZNZJBHNKWDBKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H35N3O.C25H29Cl2N3O.C23H26BrN3O.C23H23Cl2N3O.C23H25Cl2N3O.C22H23Cl2N3O/c1-3-5-6-11-22-16-18-23(19-17-22)28(32)31(24-12-7-8-13-24)21-27-29-25-14-9-10-15-26(25)30(27)20-4-2;1-17(2)13-14-29(25(31)20-9-5-6-10-21(20)27)16-24-28-22-12-11-18(26)15-23(22)30(24)19-7-3-4-8-19;1-4-13-27-21-11-6-5-10-20(21)25-22(27)16-26(14-12-17(2)3)23(28)18-8-7-9-19(24)15-18;1-2-13-27-21-10-6-5-9-20(21)26-22(27)15-28(17-7-3-4-8-17)23(29)18-12-11-16(24)14-19(18)25;1-4-12-28-21-8-6-5-7-20(21)26-22(28)15-27(13-11-16(2)3)23(29)18-14-17(24)9-10-19(18)25;1-4-11-27-20-8-6-5-7-19(20)25-21(27)14-26(13-15(2)3)22(28)16-9-10-17(23)18(24)12-16/h4,9-10,14-19,24H,2-3,5-8,11-13,20-21H2,1H3;5-6,9-12,15,17,19H,3-4,7-8,13-14,16H2,1-2H3;4-11,15,17H,1,12-14,16H2,2-3H3;2,5-6,9-12,14,17H,1,3-4,7-8,13,15H2;4-10,14,16H,1,11-13,15H2,2-3H3;4-10,12,15H,1,11,13-14H2,2-3H3.

What are the key properties of 3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide?

3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide has a molecular weight of 2603.52 g/mol, XLogP of 37.52, 46 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 3-bromo-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;N-cyclopentyl-4-pentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,4-dichloro-N-cyclopentyl-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(3-methylbutyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide;3,4-dichloro-N-(2-methylpropyl)-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]benzamide is sourced from PubChem (CID 158634065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).