N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide

C113H150ClF3N24O13 — CID 158369401

About N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide

N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide (PubChem CID 158369401) has the molecular formula C113H150ClF3N24O13 and a molecular weight of 2145.04 g/mol. Its IUPAC name is N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide.

Molecular Properties

• Compound Name: N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide
• PubChem CID: 158369401
• Molecular Formula: C113H150ClF3N24O13
• Molecular Weight: 2145.04 g/mol
• Exact Mass: 2143.15
• IUPAC Name: N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide
• SMILES: CC(C)(O)CC(=O)Nc1nc2ccc(C(C)(C)O)nc2n1C(C)(C)C.CC(C)(O)c1ccc2nc(NC(=O)C[C@](C)(O)c3ccccc3)n(C(C)(C)C)c2n1.CCC(C)(O)CC(=O)Nc1nc2ccc(C)nc2n1C1CCC1.CCC(C)(O)CC(=O)Nc1nc2ccc(Cl)nc2n1C1CCC1.Cc1ccc2nc(NC(=O)CC3(C)CCC3)n(-c3ccc(OC(F)(F)F)cc3)c2n1.Cc1ccc2nc(NC(=O)CC3(C)CCC3)n(C(C)(C)C)c2n1
• InChI: InChI=1S/C23H30N4O3.C21H21F3N4O2.C18H28N4O3.C18H26N4O.C17H24N4O2.C16H21ClN4O2/c1-21(2,3)27-19-16(12-13-17(25-19)22(4,5)29)24-20(27)26-18(28)14-23(6,30)15-10-8-7-9-11-15;1-13-4-9-16-18(25-13)28(14-5-7-15(8-6-14)30-21(22,23)24)19(26-16)27-17(29)12-20(2)10-3-11-20;1-16(2,3)22-14-11(8-9-12(20-14)18(6,7)25)19-15(22)21-13(23)10-17(4,5)24;1-12-7-8-13-15(19-12)22(17(2,3)4)16(20-13)21-14(23)11-18(5)9-6-10-18;1-4-17(3,23)10-14(22)20-16-19-13-9-8-11(2)18-15(13)21(16)12-6-5-7-12;1-3-16(2,23)9-13(22)20-15-18-11-7-8-12(17)19-14(11)21(15)10-5-4-6-10/h7-13,29-30H,14H2,1-6H3,(H,24,26,28);4-9H,3,10-12H2,1-2H3,(H,26,27,29);8-9,24-25H,10H2,1-7H3,(H,19,21,23);7-8H,6,9-11H2,1-5H3,(H,20,21,23);8-9,12,23H,4-7,10H2,1-3H3,(H,19,20,22);7-8,10,23H,3-6,9H2,1-2H3,(H,18,20,22)/t23-;;;;;/m0...../s1
• InChIKey: GUKVSRAASSDNIE-TUXSZDOYSA-N
• XLogP: 21.58
• TPSA: 489.47 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 31
• Rotatable Bonds: 27
• Heavy Atoms: 154
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2145.04
LogP ≤ 5	21.58
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide?

The IUPAC name of N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide (CID 158369401) is N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide.

What is the SMILES notation for N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide?

The canonical SMILES for N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide is CC(C)(O)CC(=O)Nc1nc2ccc(C(C)(C)O)nc2n1C(C)(C)C.CC(C)(O)c1ccc2nc(NC(=O)C[C@](C)(O)c3ccccc3)n(C(C)(C)C)c2n1.CCC(C)(O)CC(=O)Nc1nc2ccc(C)nc2n1C1CCC1.CCC(C)(O)CC(=O)Nc1nc2ccc(Cl)nc2n1C1CCC1.Cc1ccc2nc(NC(=O)CC3(C)CCC3)n(-c3ccc(OC(F)(F)F)cc3)c2n1.Cc1ccc2nc(NC(=O)CC3(C)CCC3)n(C(C)(C)C)c2n1.

What is the InChIKey of N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide?

The InChIKey is GUKVSRAASSDNIE-TUXSZDOYSA-N. The full InChI is InChI=1S/C23H30N4O3.C21H21F3N4O2.C18H28N4O3.C18H26N4O.C17H24N4O2.C16H21ClN4O2/c1-21(2,3)27-19-16(12-13-17(25-19)22(4,5)29)24-20(27)26-18(28)14-23(6,30)15-10-8-7-9-11-15;1-13-4-9-16-18(25-13)28(14-5-7-15(8-6-14)30-21(22,23)24)19(26-16)27-17(29)12-20(2)10-3-11-20;1-16(2,3)22-14-11(8-9-12(20-14)18(6,7)25)19-15(22)21-13(23)10-17(4,5)24;1-12-7-8-13-15(19-12)22(17(2,3)4)16(20-13)21-14(23)11-18(5)9-6-10-18;1-4-17(3,23)10-14(22)20-16-19-13-9-8-11(2)18-15(13)21(16)12-6-5-7-12;1-3-16(2,23)9-13(22)20-15-18-11-7-8-12(17)19-14(11)21(15)10-5-4-6-10/h7-13,29-30H,14H2,1-6H3,(H,24,26,28);4-9H,3,10-12H2,1-2H3,(H,26,27,29);8-9,24-25H,10H2,1-7H3,(H,19,21,23);7-8H,6,9-11H2,1-5H3,(H,20,21,23);8-9,12,23H,4-7,10H2,1-3H3,(H,19,20,22);7-8,10,23H,3-6,9H2,1-2H3,(H,18,20,22)/t23-;;;;;/m0...../s1.

What are the key properties of N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide?

N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide has a molecular weight of 2145.04 g/mol, XLogP of 21.58, 27 rotatable bonds, 12 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide;(3S)-N-[3-tert-butyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;N-(3-tert-butyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(1-methylcyclobutyl)acetamide;N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylpentanamide;2-(1-methylcyclobutyl)-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]acetamide is sourced from PubChem (CID 158369401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).