3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide

C114H139ClFIN20O7 — CID 161233852

About 3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide

3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide (PubChem CID 161233852) has the molecular formula C114H139ClFIN20O7 and a molecular weight of 2082.85 g/mol. Its IUPAC name is 3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide.

Molecular Properties

• Compound Name: 3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide
• PubChem CID: 161233852
• Molecular Formula: C114H139ClFIN20O7
• Molecular Weight: 2082.85 g/mol
• Exact Mass: 2080.99
• IUPAC Name: 3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide
• SMILES: CC(C)CCN(Cc1nc2cccnc2n1CC1CC1)C(=O)Cc1ccccc1F.CCCN(Cc1nc2cccnc2n1CC1CC1)C(=O)c1cccc(I)c1.CCCn1c(CN(CCC(C)C)C(=O)c2cccc(Cl)c2)nc2cccnc21.COc1cccc(CC(=O)N(CCC(C)C)Cc2nc3cccnc3n2CC2CC2)c1.Cc1cc(C(=O)N(Cc2nc3cccnc3n2CC2CC2)CC(C)C)oc1C
• InChI: InChI=1S/C25H32N4O2.C24H29FN4O.C22H27ClN4O.C22H28N4O2.C21H23IN4O/c1-18(2)11-13-28(24(30)15-20-6-4-7-21(14-20)31-3)17-23-27-22-8-5-12-26-25(22)29(23)16-19-9-10-19;1-17(2)11-13-28(23(30)14-19-6-3-4-7-20(19)25)16-22-27-21-8-5-12-26-24(21)29(22)15-18-9-10-18;1-4-12-27-20(25-19-9-6-11-24-21(19)27)15-26(13-10-16(2)3)22(28)17-7-5-8-18(23)14-17;1-14(2)11-25(22(27)19-10-15(3)16(4)28-19)13-20-24-18-6-5-9-23-21(18)26(20)12-17-7-8-17;1-2-11-25(21(27)16-5-3-6-17(22)12-16)14-19-24-18-7-4-10-23-20(18)26(19)13-15-8-9-15/h4-8,12,14,18-19H,9-11,13,15-17H2,1-3H3;3-8,12,17-18H,9-11,13-16H2,1-2H3;5-9,11,14,16H,4,10,12-13,15H2,1-3H3;5-6,9-10,14,17H,7-8,11-13H2,1-4H3;3-7,10,12,15H,2,8-9,11,13-14H2,1H3
• InChIKey: UZCMDSYIRFUKNU-UHFFFAOYSA-N
• XLogP: 23.10
• TPSA: 277.47 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 41
• Heavy Atoms: 144
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2082.85
LogP ≤ 5	23.10
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide?

The IUPAC name of 3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide (CID 161233852) is 3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide.

What is the SMILES notation for 3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide?

The canonical SMILES for 3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide is CC(C)CCN(Cc1nc2cccnc2n1CC1CC1)C(=O)Cc1ccccc1F.CCCN(Cc1nc2cccnc2n1CC1CC1)C(=O)c1cccc(I)c1.CCCn1c(CN(CCC(C)C)C(=O)c2cccc(Cl)c2)nc2cccnc21.COc1cccc(CC(=O)N(CCC(C)C)Cc2nc3cccnc3n2CC2CC2)c1.Cc1cc(C(=O)N(Cc2nc3cccnc3n2CC2CC2)CC(C)C)oc1C.

What is the InChIKey of 3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide?

The InChIKey is UZCMDSYIRFUKNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N4O2.C24H29FN4O.C22H27ClN4O.C22H28N4O2.C21H23IN4O/c1-18(2)11-13-28(24(30)15-20-6-4-7-21(14-20)31-3)17-23-27-22-8-5-12-26-25(22)29(23)16-19-9-10-19;1-17(2)11-13-28(23(30)14-19-6-3-4-7-20(19)25)16-22-27-21-8-5-12-26-24(21)29(22)15-18-9-10-18;1-4-12-27-20(25-19-9-6-11-24-21(19)27)15-26(13-10-16(2)3)22(28)17-7-5-8-18(23)14-17;1-14(2)11-25(22(27)19-10-15(3)16(4)28-19)13-20-24-18-6-5-9-23-21(18)26(20)12-17-7-8-17;1-2-11-25(21(27)16-5-3-6-17(22)12-16)14-19-24-18-7-4-10-23-20(18)26(19)13-15-8-9-15/h4-8,12,14,18-19H,9-11,13,15-17H2,1-3H3;3-8,12,17-18H,9-11,13-16H2,1-2H3;5-9,11,14,16H,4,10,12-13,15H2,1-3H3;5-6,9-10,14,17H,7-8,11-13H2,1-4H3;3-7,10,12,15H,2,8-9,11,13-14H2,1H3.

What are the key properties of 3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide?

3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide has a molecular weight of 2082.85 g/mol, XLogP of 23.10, 41 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4,5-dimethyl-N-(2-methylpropyl)furan-2-carboxamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-fluorophenyl)-N-(3-methylbutyl)acetamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-3-iodo-N-propylbenzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)-N-(3-methylbutyl)acetamide is sourced from PubChem (CID 161233852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).