N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide

C97H127Cl6F3N24O8 — CID 158738335

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

N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide (PubChem CID 158738335) has the molecular formula C97H127Cl6F3N24O8 and a molecular weight of 2026.95 g/mol. Its IUPAC name is N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide.

Molecular Properties

• Compound Name: N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide
• PubChem CID: 158738335
• Molecular Formula: C97H127Cl6F3N24O8
• Molecular Weight: 2026.95 g/mol
• Exact Mass: 2022.84
• IUPAC Name: N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide
• SMILES: C=CCn1c(NC(=O)CC(C)(C)C)nc2ccc(Cl)nc21.C=CCn1c(NC(=O)CCC2CCCC2)nc2ccc(Cl)nc21.CC(C)(C)CC(=O)Nc1nc2ccc(Cl)nc2n1C(C)(C)C.CC(C)(C)CC(=O)Nc1nc2ccc(Cl)nc2n1C1CCOCC1.CC(C)n1c(NC(=O)CC(C)(C)C)nc2ccc(Cl)nc21.CC1(C)CCCC(CC(=O)Nc2nc3ccc(Cl)nc3n2CC(F)(F)F)O1
• InChI: InChI=1S/C17H20ClF3N4O2.C17H23ClN4O2.C17H21ClN4O.C16H23ClN4O.C15H21ClN4O.C15H19ClN4O/c1-16(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;1-17(2,3)10-14(23)21-16-19-12-4-5-13(18)20-15(12)22(16)11-6-8-24-9-7-11;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;1-15(2,3)9-12(22)20-14-18-10-7-8-11(17)19-13(10)21(14)16(4,5)6;1-9(2)20-13-10(6-7-11(16)18-13)17-14(20)19-12(21)8-15(3,4)5;1-5-8-20-13-10(6-7-11(16)18-13)17-14(20)19-12(21)9-15(2,3)4/h5-6,10H,3-4,7-9H2,1-2H3,(H,22,24,26);4-5,11H,6-10H2,1-3H3,(H,19,21,23);2,8-9,12H,1,3-7,10-11H2,(H,19,21,23);7-8H,9H2,1-6H3,(H,18,20,22);6-7,9H,8H2,1-5H3,(H,17,19,21);5-7H,1,8-9H2,2-4H3,(H,17,19,21)
• InChIKey: ILYVVKWUNOTLFO-UHFFFAOYSA-N
• XLogP: 24.21
• TPSA: 377.32 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 26
• Rotatable Bonds: 22
• Heavy Atoms: 138
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2026.95
LogP ≤ 5	24.21
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	26

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-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide?

The IUPAC name of N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide (CID 158738335) is N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide.

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

The canonical SMILES for N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide is C=CCn1c(NC(=O)CC(C)(C)C)nc2ccc(Cl)nc21.C=CCn1c(NC(=O)CCC2CCCC2)nc2ccc(Cl)nc21.CC(C)(C)CC(=O)Nc1nc2ccc(Cl)nc2n1C(C)(C)C.CC(C)(C)CC(=O)Nc1nc2ccc(Cl)nc2n1C1CCOCC1.CC(C)n1c(NC(=O)CC(C)(C)C)nc2ccc(Cl)nc21.CC1(C)CCCC(CC(=O)Nc2nc3ccc(Cl)nc3n2CC(F)(F)F)O1.

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

The InChIKey is ILYVVKWUNOTLFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20ClF3N4O2.C17H23ClN4O2.C17H21ClN4O.C16H23ClN4O.C15H21ClN4O.C15H19ClN4O/c1-16(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;1-17(2,3)10-14(23)21-16-19-12-4-5-13(18)20-15(12)22(16)11-6-8-24-9-7-11;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;1-15(2,3)9-12(22)20-14-18-10-7-8-11(17)19-13(10)21(14)16(4,5)6;1-9(2)20-13-10(6-7-11(16)18-13)17-14(20)19-12(21)8-15(3,4)5;1-5-8-20-13-10(6-7-11(16)18-13)17-14(20)19-12(21)9-15(2,3)4/h5-6,10H,3-4,7-9H2,1-2H3,(H,22,24,26);4-5,11H,6-10H2,1-3H3,(H,19,21,23);2,8-9,12H,1,3-7,10-11H2,(H,19,21,23);7-8H,9H2,1-6H3,(H,18,20,22);6-7,9H,8H2,1-5H3,(H,17,19,21);5-7H,1,8-9H2,2-4H3,(H,17,19,21).

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

N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide has a molecular weight of 2026.95 g/mol, XLogP of 24.21, 22 rotatable bonds, 6 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;N-(5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3-cyclopentylpropanamide;N-(5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-yl)-3,3-dimethylbutanamide;N-[5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-yl]-2-(6,6-dimethyloxan-2-yl)acetamide is sourced from PubChem (CID 158738335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).