N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide

C118H143BrCl2F3N21O7S — CID 158505274

About N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide

N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide (PubChem CID 158505274) has the molecular formula C118H143BrCl2F3N21O7S and a molecular weight of 2207.45 g/mol. Its IUPAC name is N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide.

Molecular Properties

• Compound Name: N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
• PubChem CID: 158505274
• Molecular Formula: C118H143BrCl2F3N21O7S
• Molecular Weight: 2207.45 g/mol
• Exact Mass: 2203.97
• IUPAC Name: N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
• SMILES: CCCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1c(F)cccc1Cl.CCCN(Cc1nc2cccnc2n1CCC)C(=O)c1cc(F)ccc1F.CCCn1c(CN(CCC(C)C)C(=O)c2cccc(OCCNCCOCC(C)C)c2)nc2cccnc21.CCCn1c(CN(CCC(C)C)C(=O)c2ccccc2Br)nc2cccnc21.CCCn1c(CN(Cc2ccccc2)C(=O)c2sccc2Cl)nc2cccnc21
• InChI: InChI=1S/C30H45N5O3.C24H28ClFN4O.C22H27BrN4O.C22H21ClN4OS.C20H22F2N4O/c1-6-16-35-28(33-27-11-8-13-32-29(27)35)21-34(17-12-23(2)3)30(36)25-9-7-10-26(20-25)38-19-15-31-14-18-37-22-24(4)5;1-2-3-6-15-29(24(31)22-18(25)11-7-12-19(22)26)16-21-28-20-13-8-14-27-23(20)30(21)17-9-4-5-10-17;1-4-13-27-20(25-19-10-7-12-24-21(19)27)15-26(14-11-16(2)3)22(28)17-8-5-6-9-18(17)23;1-2-12-27-19(25-18-9-6-11-24-21(18)27)15-26(14-16-7-4-3-5-8-16)22(28)20-17(23)10-13-29-20;1-3-10-25(20(27)15-12-14(21)7-8-16(15)22)13-18-24-17-6-5-9-23-19(17)26(18)11-4-2/h7-11,13,20,23-24,31H,6,12,14-19,21-22H2,1-5H3;7-8,11-14,17H,2-6,9-10,15-16H2,1H3;5-10,12,16H,4,11,13-15H2,1-3H3;3-11,13H,2,12,14-15H2,1H3;5-9,12H,3-4,10-11,13H2,1-2H3
• InChIKey: HKJUNJBEOPMJHB-UHFFFAOYSA-N
• XLogP: 26.21
• TPSA: 285.59 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 24
• Rotatable Bonds: 47
• Heavy Atoms: 153
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2207.45
LogP ≤ 5	26.21
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

The IUPAC name of N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide (CID 158505274) is N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide.

What is the SMILES notation for N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

The canonical SMILES for N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide is CCCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1c(F)cccc1Cl.CCCN(Cc1nc2cccnc2n1CCC)C(=O)c1cc(F)ccc1F.CCCn1c(CN(CCC(C)C)C(=O)c2cccc(OCCNCCOCC(C)C)c2)nc2cccnc21.CCCn1c(CN(CCC(C)C)C(=O)c2ccccc2Br)nc2cccnc21.CCCn1c(CN(Cc2ccccc2)C(=O)c2sccc2Cl)nc2cccnc21.

What is the InChIKey of N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

The InChIKey is HKJUNJBEOPMJHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H45N5O3.C24H28ClFN4O.C22H27BrN4O.C22H21ClN4OS.C20H22F2N4O/c1-6-16-35-28(33-27-11-8-13-32-29(27)35)21-34(17-12-23(2)3)30(36)25-9-7-10-26(20-25)38-19-15-31-14-18-37-22-24(4)5;1-2-3-6-15-29(24(31)22-18(25)11-7-12-19(22)26)16-21-28-20-13-8-14-27-23(20)30(21)17-9-4-5-10-17;1-4-13-27-20(25-19-10-7-12-24-21(19)27)15-26(14-11-16(2)3)22(28)17-8-5-6-9-18(17)23;1-2-12-27-19(25-18-9-6-11-24-21(18)27)15-26(14-16-7-4-3-5-8-16)22(28)20-17(23)10-13-29-20;1-3-10-25(20(27)15-12-14(21)7-8-16(15)22)13-18-24-17-6-5-9-23-19(17)26(18)11-4-2/h7-11,13,20,23-24,31H,6,12,14-19,21-22H2,1-5H3;7-8,11-14,17H,2-6,9-10,15-16H2,1H3;5-10,12,16H,4,11,13-15H2,1-3H3;3-11,13H,2,12,14-15H2,1H3;5-9,12H,3-4,10-11,13H2,1-2H3.

What are the key properties of N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide has a molecular weight of 2207.45 g/mol, XLogP of 26.21, 47 rotatable bonds, 1 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for N-benzyl-3-chloro-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide;2-bromo-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;2-chloro-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-6-fluoro-N-pentylbenzamide;2,5-difluoro-N-propyl-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-(3-methylbutyl)-3-[2-[2-(2-methylpropoxy)ethylamino]ethoxy]-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide is sourced from PubChem (CID 158505274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).