N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide

C117H142Cl2F2N20O6 — CID 159286400

About N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide

N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide (PubChem CID 159286400) has the molecular formula C117H142Cl2F2N20O6 and a molecular weight of 2033.46 g/mol. Its IUPAC name is N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide.

Molecular Properties

• Compound Name: N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
• PubChem CID: 159286400
• Molecular Formula: C117H142Cl2F2N20O6
• Molecular Weight: 2033.46 g/mol
• Exact Mass: 2031.08
• IUPAC Name: N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
• SMILES: CC(C)CN(Cc1nc2cccnc2n1CC1CC1)C(=O)/C=C/c1ccccc1Cl.CCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1cccc(F)c1.CCCn1c(CN(CCC(C)C)C(=O)c2ccc(F)c(Cl)c2)nc2cccnc21.CCCn1c(CN(CCC(C)C)C(=O)c2ccc(OC)cc2)nc2cccnc21.Cc1ccccc1C(=O)N(CCC(C)C)Cc1nc2cccnc2n1C1CCCC1
• InChI: InChI=1S/C25H32N4O.C24H27ClN4O.C23H27FN4O.C23H30N4O2.C22H26ClFN4O/c1-18(2)14-16-28(25(30)21-12-7-4-9-19(21)3)17-23-27-22-13-8-15-26-24(22)29(23)20-10-5-6-11-20;1-17(2)14-28(23(30)12-11-19-6-3-4-7-20(19)25)16-22-27-21-8-5-13-26-24(21)29(22)15-18-9-10-18;1-2-3-14-27(23(29)17-8-6-9-18(24)15-17)16-21-26-20-12-7-13-25-22(20)28(21)19-10-4-5-11-19;1-5-14-27-21(25-20-7-6-13-24-22(20)27)16-26(15-12-17(2)3)23(28)18-8-10-19(29-4)11-9-18;1-4-11-28-20(26-19-6-5-10-25-21(19)28)14-27(12-9-15(2)3)22(29)16-7-8-18(24)17(23)13-16/h4,7-9,12-13,15,18,20H,5-6,10-11,14,16-17H2,1-3H3;3-8,11-13,17-18H,9-10,14-16H2,1-2H3;6-9,12-13,15,19H,2-5,10-11,14,16H2,1H3;6-11,13,17H,5,12,14-16H2,1-4H3;5-8,10,13,15H,4,9,11-12,14H2,1-3H3/b;12-11+
• InChIKey: KZOJBZSGOZITMF-HDWVHSOMSA-N
• XLogP: 25.72
• TPSA: 264.33 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 39
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2033.46
LogP ≤ 5	25.72
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

The IUPAC name of N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide (CID 159286400) is N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide.

What is the SMILES notation for N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

The canonical SMILES for N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide is CC(C)CN(Cc1nc2cccnc2n1CC1CC1)C(=O)/C=C/c1ccccc1Cl.CCCCN(Cc1nc2cccnc2n1C1CCCC1)C(=O)c1cccc(F)c1.CCCn1c(CN(CCC(C)C)C(=O)c2ccc(F)c(Cl)c2)nc2cccnc21.CCCn1c(CN(CCC(C)C)C(=O)c2ccc(OC)cc2)nc2cccnc21.Cc1ccccc1C(=O)N(CCC(C)C)Cc1nc2cccnc2n1C1CCCC1.

What is the InChIKey of N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

The InChIKey is KZOJBZSGOZITMF-HDWVHSOMSA-N. The full InChI is InChI=1S/C25H32N4O.C24H27ClN4O.C23H27FN4O.C23H30N4O2.C22H26ClFN4O/c1-18(2)14-16-28(25(30)21-12-7-4-9-19(21)3)17-23-27-22-13-8-15-26-24(22)29(23)20-10-5-6-11-20;1-17(2)14-28(23(30)12-11-19-6-3-4-7-20(19)25)16-22-27-21-8-5-13-26-24(21)29(22)15-18-9-10-18;1-2-3-14-27(23(29)17-8-6-9-18(24)15-17)16-21-26-20-12-7-13-25-22(20)28(21)19-10-4-5-11-19;1-5-14-27-21(25-20-7-6-13-24-22(20)27)16-26(15-12-17(2)3)23(28)18-8-10-19(29-4)11-9-18;1-4-11-28-20(26-19-6-5-10-25-21(19)28)14-27(12-9-15(2)3)22(29)16-7-8-18(24)17(23)13-16/h4,7-9,12-13,15,18,20H,5-6,10-11,14,16-17H2,1-3H3;3-8,11-13,17-18H,9-10,14-16H2,1-2H3;6-9,12-13,15,19H,2-5,10-11,14,16H2,1H3;6-11,13,17H,5,12,14-16H2,1-4H3;5-8,10,13,15H,4,9,11-12,14H2,1-3H3/b;12-11+;;;.

What are the key properties of N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide?

N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide has a molecular weight of 2033.46 g/mol, XLogP of 25.72, 39 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for N-butyl-N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluorobenzamide;3-chloro-4-fluoro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;(E)-3-(2-chlorophenyl)-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)prop-2-enamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;4-methoxy-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide is sourced from PubChem (CID 159286400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).