3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide

C107H130Cl6F4N24O10 — CID 157388122

About 3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide

3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide (PubChem CID 157388122) has the molecular formula C107H130Cl6F4N24O10 and a molecular weight of 2201.08 g/mol. Its IUPAC name is 3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide.

Molecular Properties

• Compound Name: 3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide
• PubChem CID: 157388122
• Molecular Formula: C107H130Cl6F4N24O10
• Molecular Weight: 2201.08 g/mol
• Exact Mass: 2196.85
• IUPAC Name: 3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide
• SMILES: CC(C)(C)CC(=O)Nc1nc2cc(Cl)c(Cl)nc2n1CC(F)(F)F.CC1(F)CCC(OCCC(=O)Nc2nc3ccc(Cl)nc3n2C2CCC2)CC1.COCC(C)(C)C(=O)Nc1nc2ccc(Cl)nc2n1C1CCC1.Cc1cnc2c(c1)nc(NC(=O)C[C@@H](C)c1ccccc1)n2C1CCC1.O=C(CCOC1CCC1)Nc1nc2ccc(Cl)nc2n1C1CCC1.O=C(CCOC1C[C@@H]2C[C@@H]2C1)Nc1nc2ccc(Cl)nc2n1C1CCC1
• InChI: InChI=1S/C21H24N4O.C20H26ClFN4O2.C19H23ClN4O2.C17H21ClN4O2.C16H21ClN4O2.C14H15Cl2F3N4O/c1-14-11-18-20(22-13-14)25(17-9-6-10-17)21(23-18)24-19(26)12-15(2)16-7-4-3-5-8-16;1-20(22)10-7-14(8-11-20)28-12-9-17(27)25-19-23-15-5-6-16(21)24-18(15)26(19)13-3-2-4-13;20-16-5-4-15-18(22-16)24(13-2-1-3-13)19(21-15)23-17(25)6-7-26-14-9-11-8-12(11)10-14;18-14-8-7-13-16(20-14)22(11-3-1-4-11)17(19-13)21-15(23)9-10-24-12-5-2-6-12;1-16(2,9-23-3)14(22)20-15-18-11-7-8-12(17)19-13(11)21(15)10-5-4-6-10;1-13(2,3)5-9(24)21-12-20-8-4-7(15)10(16)22-11(8)23(12)6-14(17,18)19/h3-5,7-8,11,13,15,17H,6,9-10,12H2,1-2H3,(H,23,24,26);5-6,13-14H,2-4,7-12H2,1H3,(H,23,25,27);4-5,11-14H,1-3,6-10H2,(H,21,23,25);7-8,11-12H,1-6,9-10H2,(H,19,21,23);7-8,10H,4-6,9H2,1-3H3,(H,18,20,22);4H,5-6H2,1-3H3,(H,20,21,24)/t15-;;11-,12+,14?;;;/m1...../s1
• InChIKey: BLRCYZKBQHSKNR-YYMCVYAMSA-N
• XLogP: 25.18
• TPSA: 395.78 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 28
• Rotatable Bonds: 31
• Heavy Atoms: 151
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2201.08
LogP ≤ 5	25.18
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide?

The IUPAC name of 3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide (CID 157388122) is 3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide.

What is the SMILES notation for 3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide?

The canonical SMILES for 3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide is CC(C)(C)CC(=O)Nc1nc2cc(Cl)c(Cl)nc2n1CC(F)(F)F.CC1(F)CCC(OCCC(=O)Nc2nc3ccc(Cl)nc3n2C2CCC2)CC1.COCC(C)(C)C(=O)Nc1nc2ccc(Cl)nc2n1C1CCC1.Cc1cnc2c(c1)nc(NC(=O)C[C@@H](C)c1ccccc1)n2C1CCC1.O=C(CCOC1CCC1)Nc1nc2ccc(Cl)nc2n1C1CCC1.O=C(CCOC1C[C@@H]2C[C@@H]2C1)Nc1nc2ccc(Cl)nc2n1C1CCC1.

What is the InChIKey of 3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide?

The InChIKey is BLRCYZKBQHSKNR-YYMCVYAMSA-N. The full InChI is InChI=1S/C21H24N4O.C20H26ClFN4O2.C19H23ClN4O2.C17H21ClN4O2.C16H21ClN4O2.C14H15Cl2F3N4O/c1-14-11-18-20(22-13-14)25(17-9-6-10-17)21(23-18)24-19(26)12-15(2)16-7-4-3-5-8-16;1-20(22)10-7-14(8-11-20)28-12-9-17(27)25-19-23-15-5-6-16(21)24-18(15)26(19)13-3-2-4-13;20-16-5-4-15-18(22-16)24(13-2-1-3-13)19(21-15)23-17(25)6-7-26-14-9-11-8-12(11)10-14;18-14-8-7-13-16(20-14)22(11-3-1-4-11)17(19-13)21-15(23)9-10-24-12-5-2-6-12;1-16(2,9-23-3)14(22)20-15-18-11-7-8-12(17)19-13(11)21(15)10-5-4-6-10;1-13(2,3)5-9(24)21-12-20-8-4-7(15)10(16)22-11(8)23(12)6-14(17,18)19/h3-5,7-8,11,13,15,17H,6,9-10,12H2,1-2H3,(H,23,24,26);5-6,13-14H,2-4,7-12H2,1H3,(H,23,25,27);4-5,11-14H,1-3,6-10H2,(H,21,23,25);7-8,11-12H,1-6,9-10H2,(H,19,21,23);7-8,10H,4-6,9H2,1-3H3,(H,18,20,22);4H,5-6H2,1-3H3,(H,20,21,24)/t15-;;11-,12+,14?;;;/m1...../s1.

What are the key properties of 3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide?

3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide has a molecular weight of 2201.08 g/mol, XLogP of 25.18, 31 rotatable bonds, 6 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[[(1S,5R)-3-bicyclo[3.1.0]hexanyl]oxy]-N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)propanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-cyclobutyloxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(4-fluoro-4-methylcyclohexyl)oxypropanamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-2,2-dimethylpropanamide;(3R)-N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-[5,6-dichloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide is sourced from PubChem (CID 157388122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).