N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide

C109H138ClF2N31O7 — CID 161002044

About N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide

N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide (PubChem CID 161002044) has the molecular formula C109H138ClF2N31O7 and a molecular weight of 2067.96 g/mol. Its IUPAC name is N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide.

Molecular Properties

• Compound Name: N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide
• PubChem CID: 161002044
• Molecular Formula: C109H138ClF2N31O7
• Molecular Weight: 2067.96 g/mol
• Exact Mass: 2066.11
• IUPAC Name: N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide
• SMILES: CC1CCN(c2ccc3nc(NC(=O)CC(C)(C)C)n(C4CCC4)c3n2)CC1.Cc1cc(-n2c(NC(=O)CC(C)(C)C)nc3ccc(C)nc32)on1.Cc1ccc2nc(NC(=O)CC(C)(C)C)n(-c3cn(C)nn3)c2n1.Cc1ccc2nc(NC(=O)CC3CC(C)(F)C3)n(-c3ccc(F)cn3)c2n1.O=C(CC1CCCCC1)Nc1nc2ccc(Cl)nc2n1C1CCC1.[C-]#[N+]c1ccc2nc(NC(=O)[C@@H](C)C(C)C)n(C3CCC3)c2n1
• InChI: InChI=1S/C22H33N5O.C19H19F2N5O.C18H23ClN4O.C17H21N5O2.C17H21N5O.C16H21N7O/c1-15-10-12-26(13-11-15)18-9-8-17-20(24-18)27(16-6-5-7-16)21(23-17)25-19(28)14-22(2,3)4;1-11-3-5-14-17(23-11)26(15-6-4-13(20)10-22-15)18(24-14)25-16(27)7-12-8-19(2,21)9-12;19-15-10-9-14-17(21-15)23(13-7-4-8-13)18(20-14)22-16(24)11-12-5-2-1-3-6-12;1-10-6-7-12-15(18-10)22(14-8-11(2)21-24-14)16(19-12)20-13(23)9-17(3,4)5;1-10(2)11(3)16(23)21-17-19-13-8-9-14(18-4)20-15(13)22(17)12-6-5-7-12;1-10-6-7-11-14(17-10)23(12-9-22(5)21-20-12)15(18-11)19-13(24)8-16(2,3)4/h8-9,15-16H,5-7,10-14H2,1-4H3,(H,23,25,28);3-6,10,12H,7-9H2,1-2H3,(H,24,25,27);9-10,12-13H,1-8,11H2,(H,20,22,24);6-8H,9H2,1-5H3,(H,19,20,23);8-12H,5-7H2,1-3H3,(H,19,21,23);6-7,9H,8H2,1-5H3,(H,18,19,24)/t;;;;11-;/m....0./s1
• InChIKey: TVZXESVGJQMYNK-FQDKWIBCSA-N
• XLogP: 22.79
• TPSA: 436.09 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 31
• Rotatable Bonds: 22
• Heavy Atoms: 150
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2067.96
LogP ≤ 5	22.79
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide?

The IUPAC name of N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide (CID 161002044) is N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide.

What is the SMILES notation for N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide?

The canonical SMILES for N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide is CC1CCN(c2ccc3nc(NC(=O)CC(C)(C)C)n(C4CCC4)c3n2)CC1.Cc1cc(-n2c(NC(=O)CC(C)(C)C)nc3ccc(C)nc32)on1.Cc1ccc2nc(NC(=O)CC(C)(C)C)n(-c3cn(C)nn3)c2n1.Cc1ccc2nc(NC(=O)CC3CC(C)(F)C3)n(-c3ccc(F)cn3)c2n1.O=C(CC1CCCCC1)Nc1nc2ccc(Cl)nc2n1C1CCC1.[C-]#[N+]c1ccc2nc(NC(=O)[C@@H](C)C(C)C)n(C3CCC3)c2n1.

What is the InChIKey of N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide?

The InChIKey is TVZXESVGJQMYNK-FQDKWIBCSA-N. The full InChI is InChI=1S/C22H33N5O.C19H19F2N5O.C18H23ClN4O.C17H21N5O2.C17H21N5O.C16H21N7O/c1-15-10-12-26(13-11-15)18-9-8-17-20(24-18)27(16-6-5-7-16)21(23-17)25-19(28)14-22(2,3)4;1-11-3-5-14-17(23-11)26(15-6-4-13(20)10-22-15)18(24-14)25-16(27)7-12-8-19(2,21)9-12;19-15-10-9-14-17(21-15)23(13-7-4-8-13)18(20-14)22-16(24)11-12-5-2-1-3-6-12;1-10-6-7-12-15(18-10)22(14-8-11(2)21-24-14)16(19-12)20-13(23)9-17(3,4)5;1-10(2)11(3)16(23)21-17-19-13-8-9-14(18-4)20-15(13)22(17)12-6-5-7-12;1-10-6-7-11-14(17-10)23(12-9-22(5)21-20-12)15(18-11)19-13(24)8-16(2,3)4/h8-9,15-16H,5-7,10-14H2,1-4H3,(H,23,25,28);3-6,10,12H,7-9H2,1-2H3,(H,24,25,27);9-10,12-13H,1-8,11H2,(H,20,22,24);6-8H,9H2,1-5H3,(H,19,20,23);8-12H,5-7H2,1-3H3,(H,19,21,23);6-7,9H,8H2,1-5H3,(H,18,19,24)/t;;;;11-;/m....0./s1.

What are the key properties of N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide?

N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide has a molecular weight of 2067.96 g/mol, XLogP of 22.79, 22 rotatable bonds, 6 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-2-cyclohexylacetamide;(2S)-N-(3-cyclobutyl-5-isocyanoimidazo[4,5-b]pyridin-2-yl)-2,3-dimethylbutanamide;N-[3-cyclobutyl-5-(4-methylpiperidin-1-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;3,3-dimethyl-N-[5-methyl-3-(3-methyl-1,2-oxazol-5-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;3,3-dimethyl-N-[5-methyl-3-(1-methyltriazol-4-yl)imidazo[4,5-b]pyridin-2-yl]butanamide;2-(3-fluoro-3-methylcyclobutyl)-N-[3-(5-fluoro-2-pyridinyl)-5-methylimidazo[4,5-b]pyridin-2-yl]acetamide is sourced from PubChem (CID 161002044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).