N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide

C82H105Cl5F6N20O8 — CID 158236868

About N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide

N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide (PubChem CID 158236868) has the molecular formula C82H105Cl5F6N20O8 and a molecular weight of 1790.13 g/mol. Its IUPAC name is N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide.

Molecular Properties

• Compound Name: N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide
• PubChem CID: 158236868
• Molecular Formula: C82H105Cl5F6N20O8
• Molecular Weight: 1790.13 g/mol
• Exact Mass: 1786.68
• IUPAC Name: N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide
• SMILES: C=CCn1c(NC(=O)CCC2CCCC2)nc2ccc(Cl)nc21.CC(C)(C)OCCC(=O)Nc1nc2ccc(Cl)nc2n1CC(F)(F)F.CC(C)n1c(NC(=O)CC(C)(C)C)nc2ccc(Cl)nc21.CC(C)n1c(NC(=O)CC2CCCC(C)(C)O2)nc2ccc(Cl)nc21.CC1(C)CCCC(CC(=O)Nc2nc3ccc(Cl)nc3n2CC(F)(F)F)O1
• InChI: InChI=1S/C18H25ClN4O2.C17H20ClF3N4O2.C17H21ClN4O.C15H18ClF3N4O2.C15H21ClN4O/c1-11(2)23-16-13(7-8-14(19)21-16)20-17(23)22-15(24)10-12-6-5-9-18(3,4)25-12;1-16(2)7-3-4-10(27-16)8-13(26)24-15-22-11-5-6-12(18)23-14(11)25(15)9-17(19,20)21;1-2-11-22-16-13(8-9-14(18)20-16)19-17(22)21-15(23)10-7-12-5-3-4-6-12;1-14(2,3)25-7-6-11(24)22-13-20-9-4-5-10(16)21-12(9)23(13)8-15(17,18)19;1-9(2)20-13-10(6-7-11(16)18-13)17-14(20)19-12(21)8-15(3,4)5/h7-8,11-12H,5-6,9-10H2,1-4H3,(H,20,22,24);5-6,10H,3-4,7-9H2,1-2H3,(H,22,24,26);2,8-9,12H,1,3-7,10-11H2,(H,19,21,23);4-5H,6-8H2,1-3H3,(H,20,22,24);6-7,9H,8H2,1-5H3,(H,17,19,21)
• InChIKey: GFBKYUIBLKGJJC-UHFFFAOYSA-N
• XLogP: 20.68
• TPSA: 326.74 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 23
• Rotatable Bonds: 22
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1790.13
LogP ≤ 5	20.68
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide?

The IUPAC name of N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide (CID 158236868) is N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide.

What is the SMILES notation for N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide?

The canonical SMILES for N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide is C=CCn1c(NC(=O)CCC2CCCC2)nc2ccc(Cl)nc21.CC(C)(C)OCCC(=O)Nc1nc2ccc(Cl)nc2n1CC(F)(F)F.CC(C)n1c(NC(=O)CC(C)(C)C)nc2ccc(Cl)nc21.CC(C)n1c(NC(=O)CC2CCCC(C)(C)O2)nc2ccc(Cl)nc21.CC1(C)CCCC(CC(=O)Nc2nc3ccc(Cl)nc3n2CC(F)(F)F)O1.

What is the InChIKey of N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide?

The InChIKey is GFBKYUIBLKGJJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25ClN4O2.C17H20ClF3N4O2.C17H21ClN4O.C15H18ClF3N4O2.C15H21ClN4O/c1-11(2)23-16-13(7-8-14(19)21-16)20-17(23)22-15(24)10-12-6-5-9-18(3,4)25-12;1-16(2)7-3-4-10(27-16)8-13(26)24-15-22-11-5-6-12(18)23-14(11)25(15)9-17(19,20)21;1-2-11-22-16-13(8-9-14(18)20-16)19-17(22)21-15(23)10-7-12-5-3-4-6-12;1-14(2,3)25-7-6-11(24)22-13-20-9-4-5-10(16)21-12(9)23(13)8-15(17,18)19;1-9(2)20-13-10(6-7-11(16)18-13)17-14(20)19-12(21)8-15(3,4)5/h7-8,11-12H,5-6,9-10H2,1-4H3,(H,20,22,24);5-6,10H,3-4,7-9H2,1-2H3,(H,22,24,26);2,8-9,12H,1,3-7,10-11H2,(H,19,21,23);4-5H,6-8H2,1-3H3,(H,20,22,24);6-7,9H,8H2,1-5H3,(H,17,19,21).

What are the key properties of N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide?

N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide has a molecular weight of 1790.13 g/mol, XLogP of 20.68, 22 rotatable bonds, 5 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-2-(6,6-dimethyloxan-2-yl)acetamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-3-[(2-methylpropan-2-yl)oxy]propanamide is sourced from PubChem (CID 158236868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).