6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate

C69H86Cl4FN17O6 — CID 159716559

About 6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate

6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate (PubChem CID 159716559) has the molecular formula C69H86Cl4FN17O6 and a molecular weight of 1410.37 g/mol. Its IUPAC name is 6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate.

Molecular Properties

• Compound Name: 6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate
• PubChem CID: 159716559
• Molecular Formula: C69H86Cl4FN17O6
• Molecular Weight: 1410.37 g/mol
• Exact Mass: 1407.57
• IUPAC Name: 6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate
• SMILES: C=C(Nc1nc2cc(Cl)cnc2n1C1CCC1)C(C)(C)COC(C)(C)C.CC(C)(C)CC(=O)Nc1nc2ccc(Cl)nc2n1-c1ccc(F)cn1.CC(C)COC(=O)Nc1nc2ccc(Cl)nc2n1C1CCC1.O=C(CCC1CCCO1)Nc1nc2cc(Cl)cnc2n1C1CCC1
• InChI: InChI=1S/C20H29ClN4O.C17H17ClFN5O.C17H21ClN4O2.C15H19ClN4O2/c1-13(20(5,6)12-26-19(2,3)4)23-18-24-16-10-14(21)11-22-17(16)25(18)15-8-7-9-15;1-17(2,3)8-14(25)23-16-21-11-5-6-12(18)22-15(11)24(16)13-7-4-10(19)9-20-13;18-11-9-14-16(19-10-11)22(12-3-1-4-12)17(20-14)21-15(23)7-6-13-5-2-8-24-13;1-9(2)8-22-15(21)19-14-17-11-6-7-12(16)18-13(11)20(14)10-4-3-5-10/h10-11,15H,1,7-9,12H2,2-6H3,(H,23,24);4-7,9H,8H2,1-3H3,(H,21,23,25);9-10,12-13H,1-8H2,(H,20,21,23);6-7,9-10H,3-5,8H2,1-2H3,(H,17,19,21)
• InChIKey: MZMVWPPPDYSNJI-UHFFFAOYSA-N
• XLogP: 17.28
• TPSA: 262.75 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 20
• Rotatable Bonds: 18
• Heavy Atoms: 97
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1410.37
LogP ≤ 5	17.28
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate?

The IUPAC name of 6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate (CID 159716559) is 6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate.

What is the SMILES notation for 6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate?

The canonical SMILES for 6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate is C=C(Nc1nc2cc(Cl)cnc2n1C1CCC1)C(C)(C)COC(C)(C)C.CC(C)(C)CC(=O)Nc1nc2ccc(Cl)nc2n1-c1ccc(F)cn1.CC(C)COC(=O)Nc1nc2ccc(Cl)nc2n1C1CCC1.O=C(CCC1CCCO1)Nc1nc2cc(Cl)cnc2n1C1CCC1.

What is the InChIKey of 6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate?

The InChIKey is MZMVWPPPDYSNJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29ClN4O.C17H17ClFN5O.C17H21ClN4O2.C15H19ClN4O2/c1-13(20(5,6)12-26-19(2,3)4)23-18-24-16-10-14(21)11-22-17(16)25(18)15-8-7-9-15;1-17(2,3)8-14(25)23-16-21-11-5-6-12(18)22-15(11)24(16)13-7-4-10(19)9-20-13;18-11-9-14-16(19-10-11)22(12-3-1-4-12)17(20-14)21-15(23)7-6-13-5-2-8-24-13;1-9(2)8-22-15(21)19-14-17-11-6-7-12(16)18-13(11)20(14)10-4-3-5-10/h10-11,15H,1,7-9,12H2,2-6H3,(H,23,24);4-7,9H,8H2,1-3H3,(H,21,23,25);9-10,12-13H,1-8H2,(H,20,21,23);6-7,9-10H,3-5,8H2,1-2H3,(H,17,19,21).

What are the key properties of 6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate?

6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate has a molecular weight of 1410.37 g/mol, XLogP of 17.28, 18 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 6-chloro-3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]imidazo[4,5-b]pyridin-2-amine;N-(6-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;N-[5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;2-methylpropyl N-(5-chloro-3-cyclobutylimidazo[4,5-b]pyridin-2-yl)carbamate is sourced from PubChem (CID 159716559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).