2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide

C90H106BrCl2F3N16O4 — CID 159236011

About 2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide

2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide (PubChem CID 159236011) has the molecular formula C90H106BrCl2F3N16O4 and a molecular weight of 1683.75 g/mol. Its IUPAC name is 2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide.

Molecular Properties

• Compound Name: 2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
• PubChem CID: 159236011
• Molecular Formula: C90H106BrCl2F3N16O4
• Molecular Weight: 1683.75 g/mol
• Exact Mass: 1680.71
• IUPAC Name: 2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
• SMILES: CCCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1ccccc1Br.CCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1cccc(Cl)c1Cl.CCCCN(Cc1nc2cccnc2n1CCC)C(=O)c1cccc(C(F)(F)F)c1.CCCN(Cc1nc2cccnc2n1CCC)C(=O)c1cccc(C)c1
• InChI: InChI=1S/C24H29BrN4O.C23H26Cl2N4O.C22H25F3N4O.C21H26N4O/c1-2-3-8-16-28(24(30)19-12-6-7-13-20(19)25)17-22-27-21-14-9-15-26-23(21)29(22)18-10-4-5-11-18;1-2-3-14-28(23(30)17-10-6-11-18(24)21(17)25)15-20-27-19-12-7-13-26-22(19)29(20)16-8-4-5-9-16;1-3-5-13-28(21(30)16-8-6-9-17(14-16)22(23,24)25)15-19-27-18-10-7-11-26-20(18)29(19)12-4-2;1-4-12-24(21(26)17-9-6-8-16(3)14-17)15-19-23-18-10-7-11-22-20(18)25(19)13-5-2/h6-7,9,12-15,18H,2-5,8,10-11,16-17H2,1H3;6-7,10-13,16H,2-5,8-9,14-15H2,1H3;6-11,14H,3-5,12-13,15H2,1-2H3;6-11,14H,4-5,12-13,15H2,1-3H3
• InChIKey: KTMAUIDWTBWEEG-UHFFFAOYSA-N
• XLogP: 21.94
• TPSA: 204.08 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 30
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1683.75
LogP ≤ 5	21.94
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

The IUPAC name of 2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide (CID 159236011) is 2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide.

What is the SMILES notation for 2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

The canonical SMILES for 2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide is CCCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1ccccc1Br.CCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1cccc(Cl)c1Cl.CCCCN(Cc1nc2cccnc2n1CCC)C(=O)c1cccc(C(F)(F)F)c1.CCCN(Cc1nc2cccnc2n1CCC)C(=O)c1cccc(C)c1.

What is the InChIKey of 2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

The InChIKey is KTMAUIDWTBWEEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29BrN4O.C23H26Cl2N4O.C22H25F3N4O.C21H26N4O/c1-2-3-8-16-28(24(30)19-12-6-7-13-20(19)25)17-22-27-21-14-9-15-26-23(21)29(22)18-10-4-5-11-18;1-2-3-14-28(23(30)17-10-6-11-18(24)21(17)25)15-20-27-19-12-7-13-26-22(19)29(20)16-8-4-5-9-16;1-3-5-13-28(21(30)16-8-6-9-17(14-16)22(23,24)25)15-19-27-18-10-7-11-26-20(18)29(19)12-4-2;1-4-12-24(21(26)17-9-6-8-16(3)14-17)15-19-23-18-10-7-11-22-20(18)25(19)13-5-2/h6-7,9,12-15,18H,2-5,8,10-11,16-17H2,1H3;6-7,10-13,16H,2-5,8-9,14-15H2,1H3;6-11,14H,3-5,12-13,15H2,1-2H3;6-11,14H,4-5,12-13,15H2,1-3H3.

What are the key properties of 2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide has a molecular weight of 1683.75 g/mol, XLogP of 21.94, 30 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-N-pentylbenzamide;N-butyl-2,3-dichloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-butyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]-3-(trifluoromethyl)benzamide;3-methyl-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide is sourced from PubChem (CID 159236011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).