2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide

C116H144Cl2N24O8 — CID 160923581

About 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide

2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide (PubChem CID 160923581) has the molecular formula C116H144Cl2N24O8 and a molecular weight of 2073.49 g/mol. Its IUPAC name is 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide.

Molecular Properties

• Compound Name: 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide
• PubChem CID: 160923581
• Molecular Formula: C116H144Cl2N24O8
• Molecular Weight: 2073.49 g/mol
• Exact Mass: 2071.10
• IUPAC Name: 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide
• SMILES: CC(C)(C)CC(=O)Nc1nc2ccc(OCc3ccccc3)nc2n1C1CCC1.CC1(CCC(=O)Nc2nc3ccc(Cl)nc3n2C2CCC2)CC1.Cc1ccc2nc(NC(=O)CC3CC3(C)C)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)CC3CC4(C)CCO[C@H]34)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)CC3Cc4ccccc43)n(C3CCC3)c2n1.Cc1nc2c(cc1Cl)nc(NC(=O)CC(C)(C)C)n2C1CCC1
• InChI: InChI=1S/C23H28N4O2.C21H22N4O.C20H26N4O2.C18H24N4O.C17H21ClN4O.C17H23ClN4O/c1-23(2,3)14-19(28)25-22-24-18-12-13-20(29-15-16-8-5-4-6-9-16)26-21(18)27(22)17-10-7-11-17;1-13-9-10-18-20(22-13)25(16-6-4-7-16)21(23-18)24-19(26)12-15-11-14-5-2-3-8-17(14)15;1-12-6-7-15-18(21-12)24(14-4-3-5-14)19(22-15)23-16(25)10-13-11-20(2)8-9-26-17(13)20;1-11-7-8-14-16(19-11)22(13-5-4-6-13)17(20-14)21-15(23)9-12-10-18(12,2)3;1-17(9-10-17)8-7-14(23)21-16-19-12-5-6-13(18)20-15(12)22(16)11-3-2-4-11;1-10-12(18)8-13-15(19-10)22(11-6-5-7-11)16(20-13)21-14(23)9-17(2,3)4/h4-6,8-9,12-13,17H,7,10-11,14-15H2,1-3H3,(H,24,25,28);2-3,5,8-10,15-16H,4,6-7,11-12H2,1H3,(H,23,24,26);6-7,13-14,17H,3-5,8-11H2,1-2H3,(H,22,23,25);7-8,12-13H,4-6,9-10H2,1-3H3,(H,20,21,23);5-6,11H,2-4,7-10H2,1H3,(H,19,21,23);8,11H,5-7,9H2,1-4H3,(H,20,21,23)/t;;13?,17-,20?;;;/m..1.../s1
• InChIKey: SSIRMZWSWLUVQV-RJFMRWDKSA-N
• XLogP: 25.51
• TPSA: 377.32 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 26
• Rotatable Bonds: 26
• Heavy Atoms: 150
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2073.49
LogP ≤ 5	25.51
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide?

The IUPAC name of 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide (CID 160923581) is 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide.

What is the SMILES notation for 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide?

The canonical SMILES for 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide is CC(C)(C)CC(=O)Nc1nc2ccc(OCc3ccccc3)nc2n1C1CCC1.CC1(CCC(=O)Nc2nc3ccc(Cl)nc3n2C2CCC2)CC1.Cc1ccc2nc(NC(=O)CC3CC3(C)C)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)CC3CC4(C)CCO[C@H]34)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)CC3Cc4ccccc43)n(C3CCC3)c2n1.Cc1nc2c(cc1Cl)nc(NC(=O)CC(C)(C)C)n2C1CCC1.

What is the InChIKey of 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide?

The InChIKey is SSIRMZWSWLUVQV-RJFMRWDKSA-N. The full InChI is InChI=1S/C23H28N4O2.C21H22N4O.C20H26N4O2.C18H24N4O.C17H21ClN4O.C17H23ClN4O/c1-23(2,3)14-19(28)25-22-24-18-12-13-20(29-15-16-8-5-4-6-9-16)26-21(18)27(22)17-10-7-11-17;1-13-9-10-18-20(22-13)25(16-6-4-7-16)21(23-18)24-19(26)12-15-11-14-5-2-3-8-17(14)15;1-12-6-7-15-18(21-12)24(14-4-3-5-14)19(22-15)23-16(25)10-13-11-20(2)8-9-26-17(13)20;1-11-7-8-14-16(19-11)22(13-5-4-6-13)17(20-14)21-15(23)9-12-10-18(12,2)3;1-17(9-10-17)8-7-14(23)21-16-19-12-5-6-13(18)20-15(12)22(16)11-3-2-4-11;1-10-12(18)8-13-15(19-10)22(11-6-5-7-11)16(20-13)21-14(23)9-17(2,3)4/h4-6,8-9,12-13,17H,7,10-11,14-15H2,1-3H3,(H,24,25,28);2-3,5,8-10,15-16H,4,6-7,11-12H2,1H3,(H,23,24,26);6-7,13-14,17H,3-5,8-11H2,1-2H3,(H,22,23,25);7-8,12-13H,4-6,9-10H2,1-3H3,(H,20,21,23);5-6,11H,2-4,7-10H2,1H3,(H,19,21,23);8,11H,5-7,9H2,1-4H3,(H,20,21,23)/t;;13?,17-,20?;;;/m..1.../s1.

What are the key properties of 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide?

2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide has a molecular weight of 2073.49 g/mol, XLogP of 25.51, 26 rotatable bonds, 6 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(1-methylcyclopropyl)propanamide;N-(6-chloro-3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide;N-(3-cyclobutyl-5-phenylmethoxyimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide is sourced from PubChem (CID 160923581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).