5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine

C66H74Cl4F6N28 — CID 161078862

About 5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine

5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine (PubChem CID 161078862) has the molecular formula C66H74Cl4F6N28 and a molecular weight of 1515.31 g/mol. Its IUPAC name is 5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

• Compound Name: 5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine
• PubChem CID: 161078862
• Molecular Formula: C66H74Cl4F6N28
• Molecular Weight: 1515.31 g/mol
• Exact Mass: 1512.53
• IUPAC Name: 5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine
• SMILES: C=CCn1c(N)nc2ccc(Cl)nc21.CC(C)n1c(N)nc2ccc(Cl)nc21.CCCn1c(N)nc2ccc(Cl)nc21.Cc1ccc2nc(N)n(C3CCC3)c2n1.Cc1ccc2nc(N)n(CC(F)(F)F)c2n1.Cc1ccnc2c1nc(N)n2C1CCC1.Nc1nc2ccc(Cl)nc2n1CC(F)(F)F
• InChI: InChI=1S/2C11H14N4.2C9H11ClN4.C9H9ClN4.C9H9F3N4.C8H6ClF3N4/c1-7-5-6-13-10-9(7)14-11(12)15(10)8-3-2-4-8;1-7-5-6-9-10(13-7)15(11(12)14-9)8-3-2-4-8;1-5(2)14-8-6(12-9(14)11)3-4-7(10)13-8;2*1-2-5-14-8-6(12-9(14)11)3-4-7(10)13-8;1-5-2-3-6-7(14-5)16(8(13)15-6)4-9(10,11)12;9-5-2-1-4-6(15-5)16(7(13)14-4)3-8(10,11)12/h2*5-6,8H,2-4H2,1H3,(H2,12,14);3-5H,1-2H3,(H2,11,12);3-4H,2,5H2,1H3,(H2,11,12);2-4H,1,5H2,(H2,11,12);2-3H,4H2,1H3,(H2,13,15);1-2H,3H2,(H2,13,14)
• InChIKey: UFQIVRLIYRSUBN-UHFFFAOYSA-N
• XLogP: 14.38
• TPSA: 397.11 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 28
• Rotatable Bonds: 9
• Heavy Atoms: 104
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1515.31
LogP ≤ 5	14.38
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	28

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 5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine?

The IUPAC name of 5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine (CID 161078862) is 5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine.

What is the SMILES notation for 5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine?

The canonical SMILES for 5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine is C=CCn1c(N)nc2ccc(Cl)nc21.CC(C)n1c(N)nc2ccc(Cl)nc21.CCCn1c(N)nc2ccc(Cl)nc21.Cc1ccc2nc(N)n(C3CCC3)c2n1.Cc1ccc2nc(N)n(CC(F)(F)F)c2n1.Cc1ccnc2c1nc(N)n2C1CCC1.Nc1nc2ccc(Cl)nc2n1CC(F)(F)F.

What is the InChIKey of 5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine?

The InChIKey is UFQIVRLIYRSUBN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H14N4.2C9H11ClN4.C9H9ClN4.C9H9F3N4.C8H6ClF3N4/c1-7-5-6-13-10-9(7)14-11(12)15(10)8-3-2-4-8;1-7-5-6-9-10(13-7)15(11(12)14-9)8-3-2-4-8;1-5(2)14-8-6(12-9(14)11)3-4-7(10)13-8;2*1-2-5-14-8-6(12-9(14)11)3-4-7(10)13-8;1-5-2-3-6-7(14-5)16(8(13)15-6)4-9(10,11)12;9-5-2-1-4-6(15-5)16(7(13)14-4)3-8(10,11)12/h2*5-6,8H,2-4H2,1H3,(H2,12,14);3-5H,1-2H3,(H2,11,12);3-4H,2,5H2,1H3,(H2,11,12);2-4H,1,5H2,(H2,11,12);2-3H,4H2,1H3,(H2,13,15);1-2H,3H2,(H2,13,14).

What are the key properties of 5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine?

5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine has a molecular weight of 1515.31 g/mol, XLogP of 14.38, 9 rotatable bonds, 7 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloro-3-propan-2-ylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-prop-2-enylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-propylimidazo[4,5-b]pyridin-2-amine;5-chloro-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-amine;5-methyl-3-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 161078862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).