N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide

C104H138Cl2N16O6 — CID 159223555

About N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide

N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide (PubChem CID 159223555) has the molecular formula C104H138Cl2N16O6 and a molecular weight of 1779.26 g/mol. Its IUPAC name is N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide.

Molecular Properties

• Compound Name: N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
• PubChem CID: 159223555
• Molecular Formula: C104H138Cl2N16O6
• Molecular Weight: 1779.26 g/mol
• Exact Mass: 1777.04
• IUPAC Name: N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
• SMILES: CCCCCCc1ccc(C(=O)N(CCC(C)C)Cc2nc3cccnc3n2CCC)cc1.CCCCCc1ccc(C(=O)N(CCC(C)C)Cc2nc3cccnc3n2CCC)cc1.CCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1ccc(Cl)c(Cl)c1.COc1ccc(OC)c(C(=O)N(CCC(C)C)Cc2nc3cccnc3n2C2CCCC2)c1
• InChI: InChI=1S/C28H40N4O.C27H38N4O.C26H34N4O3.C23H26Cl2N4O/c1-5-7-8-9-11-23-13-15-24(16-14-23)28(33)31(20-17-22(3)4)21-26-30-25-12-10-18-29-27(25)32(26)19-6-2;1-5-7-8-10-22-12-14-23(15-13-22)27(32)30(19-16-21(3)4)20-25-29-24-11-9-17-28-26(24)31(25)18-6-2;1-18(2)13-15-29(26(31)21-16-20(32-3)11-12-23(21)33-4)17-24-28-22-10-7-14-27-25(22)30(24)19-8-5-6-9-19;1-2-3-13-28(23(30)16-10-11-18(24)19(25)14-16)15-21-27-20-9-6-12-26-22(20)29(21)17-7-4-5-8-17/h10,12-16,18,22H,5-9,11,17,19-21H2,1-4H3;9,11-15,17,21H,5-8,10,16,18-20H2,1-4H3;7,10-12,14,16,18-19H,5-6,8-9,13,15,17H2,1-4H3;6,9-12,14,17H,2-5,7-8,13,15H2,1H3
• InChIKey: KRZPHUZGNJHKDG-UHFFFAOYSA-N
• XLogP: 24.46
• TPSA: 222.54 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 41
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1779.26
LogP ≤ 5	24.46
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

The IUPAC name of N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide (CID 159223555) is N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide.

What is the SMILES notation for N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

The canonical SMILES for N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide is CCCCCCc1ccc(C(=O)N(CCC(C)C)Cc2nc3cccnc3n2CCC)cc1.CCCCCc1ccc(C(=O)N(CCC(C)C)Cc2nc3cccnc3n2CCC)cc1.CCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1ccc(Cl)c(Cl)c1.COc1ccc(OC)c(C(=O)N(CCC(C)C)Cc2nc3cccnc3n2C2CCCC2)c1.

What is the InChIKey of N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

The InChIKey is KRZPHUZGNJHKDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H40N4O.C27H38N4O.C26H34N4O3.C23H26Cl2N4O/c1-5-7-8-9-11-23-13-15-24(16-14-23)28(33)31(20-17-22(3)4)21-26-30-25-12-10-18-29-27(25)32(26)19-6-2;1-5-7-8-10-22-12-14-23(15-13-22)27(32)30(19-16-21(3)4)20-25-29-24-11-9-17-28-26(24)31(25)18-6-2;1-18(2)13-15-29(26(31)21-16-20(32-3)11-12-23(21)33-4)17-24-28-22-10-7-14-27-25(22)30(24)19-8-5-6-9-19;1-2-3-13-28(23(30)16-10-11-18(24)19(25)14-16)15-21-27-20-9-6-12-26-22(20)29(21)17-7-4-5-8-17/h10,12-16,18,22H,5-9,11,17,19-21H2,1-4H3;9,11-15,17,21H,5-8,10,16,18-20H2,1-4H3;7,10-12,14,16,18-19H,5-6,8-9,13,15,17H2,1-4H3;6,9-12,14,17H,2-5,7-8,13,15H2,1H3.

What are the key properties of N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide has a molecular weight of 1779.26 g/mol, XLogP of 24.46, 41 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for N-butyl-3,4-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2,5-dimethoxy-N-(3-methylbutyl)benzamide;4-hexyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-4-pentyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide is sourced from PubChem (CID 159223555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).