5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine

C62H60Cl2F5N23O — CID 160667879

IUPAC5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine
SMILESCC(C)n1c(N)nc2ccc(C(F)(F)F)nc21.Nc1nc2ccc(-c3cccnc3)nc2n1C1CCC1.Nc1nc2ccc(Cl)nc2n1-c1ccc(F)cc1.Nc1nc2ccc(Cl)nc2n1-c1ccc(F)cn1.Nc1nc2ccc(N3CCOCC3)nc2n1C1CCC1
InChIInChI=1S/C15H15N5.C14H19N5O.C12H8ClFN4.C11H7ClFN5.C10H11F3N4/c16-15-19-13-7-6-12(10-3-2-8-17-9-10)18-14(13)20(15)11-4-1-5-11;15-14-16-11-4-5-12(18-6-8-20-9-7-18)17-13(11)19(14)10-2-1-3-10;13-10-6-5-9-11(17-10)18(12(15)16-9)8-3-1-7(14)2-4-8;12-8-3-2-7-10(17-8)18(11(14)16-7)9-4-1-6(13)5-15-9;1-5(2)17-8-6(15-9(17)14)3-4-7(16-8)10(11,12)13/h2-3,6-9,11H,1,4-5H2,(H2,16,19);4-5,10H,1-3,6-9H2,(H2,15,16);1-6H,(H2,15,16);1-5H,(H2,14,16);3-5H,1-2H3,(H2,14,15)
InChIKeyRMNVYOSISNQXSI-UHFFFAOYSA-N
MW1309.22 g/mol
LogP11.97
Rot. Bonds7

About 5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine

5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine (PubChem CID 160667879) has the molecular formula C62H60Cl2F5N23O and a molecular weight of 1309.22 g/mol. Its IUPAC name is 5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine
PubChem CID160667879
Molecular FormulaC62H60Cl2F5N23O
Molecular Weight1309.22 g/mol
Exact Mass1307.46
IUPAC Name5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine
SMILESCC(C)n1c(N)nc2ccc(C(F)(F)F)nc21.Nc1nc2ccc(-c3cccnc3)nc2n1C1CCC1.Nc1nc2ccc(Cl)nc2n1-c1ccc(F)cc1.Nc1nc2ccc(Cl)nc2n1-c1ccc(F)cn1.Nc1nc2ccc(N3CCOCC3)nc2n1C1CCC1
InChIInChI=1S/C15H15N5.C14H19N5O.C12H8ClFN4.C11H7ClFN5.C10H11F3N4/c16-15-19-13-7-6-12(10-3-2-8-17-9-10)18-14(13)20(15)11-4-1-5-11;15-14-16-11-4-5-12(18-6-8-20-9-7-18)17-13(11)19(14)10-2-1-3-10;13-10-6-5-9-11(17-10)18(12(15)16-9)8-3-1-7(14)2-4-8;12-8-3-2-7-10(17-8)18(11(14)16-7)9-4-1-6(13)5-15-9;1-5(2)17-8-6(15-9(17)14)3-4-7(16-8)10(11,12)13/h2-3,6-9,11H,1,4-5H2,(H2,16,19);4-5,10H,1-3,6-9H2,(H2,15,16);1-6H,(H2,15,16);1-5H,(H2,14,16);3-5H,1-2H3,(H2,14,15)
InChIKeyRMNVYOSISNQXSI-UHFFFAOYSA-N
XLogP11.97
TPSA321.90 Ų
H-Bond Donors5
H-Bond Acceptors24
Rotatable Bonds7
Heavy Atoms93
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001309.22
LogP ≤ 511.97
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

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

Analyze 5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine (CID 160667879) is 5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine is CC(C)n1c(N)nc2ccc(C(F)(F)F)nc21.Nc1nc2ccc(-c3cccnc3)nc2n1C1CCC1.Nc1nc2ccc(Cl)nc2n1-c1ccc(F)cc1.Nc1nc2ccc(Cl)nc2n1-c1ccc(F)cn1.Nc1nc2ccc(N3CCOCC3)nc2n1C1CCC1.
What is the InChIKey of 5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine?
The InChIKey is RMNVYOSISNQXSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5.C14H19N5O.C12H8ClFN4.C11H7ClFN5.C10H11F3N4/c16-15-19-13-7-6-12(10-3-2-8-17-9-10)18-14(13)20(15)11-4-1-5-11;15-14-16-11-4-5-12(18-6-8-20-9-7-18)17-13(11)19(14)10-2-1-3-10;13-10-6-5-9-11(17-10)18(12(15)16-9)8-3-1-7(14)2-4-8;12-8-3-2-7-10(17-8)18(11(14)16-7)9-4-1-6(13)5-15-9;1-5(2)17-8-6(15-9(17)14)3-4-7(16-8)10(11,12)13/h2-3,6-9,11H,1,4-5H2,(H2,16,19);4-5,10H,1-3,6-9H2,(H2,15,16);1-6H,(H2,15,16);1-5H,(H2,14,16);3-5H,1-2H3,(H2,14,15).
What are the key properties of 5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine?
5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine has a molecular weight of 1309.22 g/mol, XLogP of 11.97, 7 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-amine;5-chloro-3-(5-fluoro-2-pyridinyl)imidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-amine;3-cyclobutyl-5-pyridin-3-ylimidazo[4,5-b]pyridin-2-amine;3-propan-2-yl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 160667879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).