N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide

C95H128Cl2F6N24O9 — CID 159339749

IUPACN-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide
SMILESC=Cc1ccc2nc(NC(=O)CC(C)(C)C)n(CC(F)(F)F)c2n1.CCCn1c(NC(=O)CC(C)(C)OC)nc2ccc(Cl)nc21.CCc1ccc2nc(NC(=O)CC(C)(C)C)n(CC(F)(F)F)c2n1.COC(C)(C)CC(=O)Nc1nc2ccc(Cl)nc2n1C1CCC1.Cc1ccc2nc(NC(=O)CC(C)(C)C)n(C(C)C)c2n1.Cc1ccc2nc(NC(=O)CC(C)(C)O)n(C3CCC3)c2n1
InChIInChI=1S/C16H21ClN4O2.C16H21F3N4O.C16H19F3N4O.C16H22N4O2.C16H24N4O.C15H21ClN4O2/c1-16(2,23-3)9-13(22)20-15-18-11-7-8-12(17)19-14(11)21(15)10-5-4-6-10;2*1-5-10-6-7-11-13(20-10)23(9-16(17,18)19)14(21-11)22-12(24)8-15(2,3)4;1-10-7-8-12-14(17-10)20(11-5-4-6-11)15(18-12)19-13(21)9-16(2,3)22;1-10(2)20-14-12(8-7-11(3)17-14)18-15(20)19-13(21)9-16(4,5)6;1-5-8-20-13-10(6-7-11(16)18-13)17-14(20)19-12(21)9-15(2,3)22-4/h7-8,10H,4-6,9H2,1-3H3,(H,18,20,22);6-7H,5,8-9H2,1-4H3,(H,21,22,24);5-7H,1,8-9H2,2-4H3,(H,21,22,24);7-8,11,22H,4-6,9H2,1-3H3,(H,18,19,21);7-8,10H,9H2,1-6H3,(H,18,19,21);6-7H,5,8-9H2,1-4H3,(H,17,19,21)
InChIKeyLFZKLNCVFPCGLU-UHFFFAOYSA-N
MW1935.12 g/mol
LogP21.01
Rot. Bonds26

About N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide

N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide (PubChem CID 159339749) has the molecular formula C95H128Cl2F6N24O9 and a molecular weight of 1935.12 g/mol. Its IUPAC name is N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide.

Molecular Properties

Compound NameN-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide
PubChem CID159339749
Molecular FormulaC95H128Cl2F6N24O9
Molecular Weight1935.12 g/mol
Exact Mass1932.96
IUPAC NameN-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide
SMILESC=Cc1ccc2nc(NC(=O)CC(C)(C)C)n(CC(F)(F)F)c2n1.CCCn1c(NC(=O)CC(C)(C)OC)nc2ccc(Cl)nc21.CCc1ccc2nc(NC(=O)CC(C)(C)C)n(CC(F)(F)F)c2n1.COC(C)(C)CC(=O)Nc1nc2ccc(Cl)nc2n1C1CCC1.Cc1ccc2nc(NC(=O)CC(C)(C)C)n(C(C)C)c2n1.Cc1ccc2nc(NC(=O)CC(C)(C)O)n(C3CCC3)c2n1
InChIInChI=1S/C16H21ClN4O2.C16H21F3N4O.C16H19F3N4O.C16H22N4O2.C16H24N4O.C15H21ClN4O2/c1-16(2,23-3)9-13(22)20-15-18-11-7-8-12(17)19-14(11)21(15)10-5-4-6-10;2*1-5-10-6-7-11-13(20-10)23(9-16(17,18)19)14(21-11)22-12(24)8-15(2,3)4;1-10-7-8-12-14(17-10)20(11-5-4-6-11)15(18-12)19-13(21)9-16(2,3)22;1-10(2)20-14-12(8-7-11(3)17-14)18-15(20)19-13(21)9-16(4,5)6;1-5-8-20-13-10(6-7-11(16)18-13)17-14(20)19-12(21)9-15(2,3)22-4/h7-8,10H,4-6,9H2,1-3H3,(H,18,20,22);6-7H,5,8-9H2,1-4H3,(H,21,22,24);5-7H,1,8-9H2,2-4H3,(H,21,22,24);7-8,11,22H,4-6,9H2,1-3H3,(H,18,19,21);7-8,10H,9H2,1-6H3,(H,18,19,21);6-7H,5,8-9H2,1-4H3,(H,17,19,21)
InChIKeyLFZKLNCVFPCGLU-UHFFFAOYSA-N
XLogP21.01
TPSA397.55 Ų
H-Bond Donors7
H-Bond Acceptors27
Rotatable Bonds26
Heavy Atoms136
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001935.12
LogP ≤ 521.01
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

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

Analyze N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide?
The IUPAC name of N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide (CID 159339749) is N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide.
What is the SMILES notation for N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide?
The canonical SMILES for N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide is C=Cc1ccc2nc(NC(=O)CC(C)(C)C)n(CC(F)(F)F)c2n1.CCCn1c(NC(=O)CC(C)(C)OC)nc2ccc(Cl)nc21.CCc1ccc2nc(NC(=O)CC(C)(C)C)n(CC(F)(F)F)c2n1.COC(C)(C)CC(=O)Nc1nc2ccc(Cl)nc2n1C1CCC1.Cc1ccc2nc(NC(=O)CC(C)(C)C)n(C(C)C)c2n1.Cc1ccc2nc(NC(=O)CC(C)(C)O)n(C3CCC3)c2n1.
What is the InChIKey of N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide?
The InChIKey is LFZKLNCVFPCGLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21ClN4O2.C16H21F3N4O.C16H19F3N4O.C16H22N4O2.C16H24N4O.C15H21ClN4O2/c1-16(2,23-3)9-13(22)20-15-18-11-7-8-12(17)19-14(11)21(15)10-5-4-6-10;2*1-5-10-6-7-11-13(20-10)23(9-16(17,18)19)14(21-11)22-12(24)8-15(2,3)4;1-10-7-8-12-14(17-10)20(11-5-4-6-11)15(18-12)19-13(21)9-16(2,3)22;1-10(2)20-14-12(8-7-11(3)17-14)18-15(20)19-13(21)9-16(4,5)6;1-5-8-20-13-10(6-7-11(16)18-13)17-14(20)19-12(21)9-15(2,3)22-4/h7-8,10H,4-6,9H2,1-3H3,(H,18,20,22);6-7H,5,8-9H2,1-4H3,(H,21,22,24);5-7H,1,8-9H2,2-4H3,(H,21,22,24);7-8,11,22H,4-6,9H2,1-3H3,(H,18,19,21);7-8,10H,9H2,1-6H3,(H,18,19,21);6-7H,5,8-9H2,1-4H3,(H,17,19,21).
What are the key properties of N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide?
N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide has a molecular weight of 1935.12 g/mol, XLogP of 21.01, 26 rotatable bonds, 7 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(5-chloro-3-propylimidazo[4,5-b]pyridin-2-yl)-3-methoxy-3-methylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-methylbutanamide;3,3-dimethyl-N-(5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butanamide;N-[5-ethenyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-[5-ethyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide is sourced from PubChem (CID 159339749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).