6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one

C99H85F8N29O9 — CID 159330374

IUPAC6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one
SMILESCOc1nc2c(cc1Nc1ccc(C)cc1F)=NCN=2.COc1nc2c(cc1Nc1ccc(OC(F)(F)F)cc1)=NCN=2.COc1nc2c(cc1Nc1cccc(C)c1)=NCN=2.Cc1ccc(-c2ccc(Nc3cc4c([nH]c3=O)=NCN=4)cc2)cn1.Cc1ccc(Nc2cc3c([nH]c2=O)=NCN=3)cc1F.Cc1cccc(Nc2cc3c([nH]c2=O)=NCN=3)c1.O=c1[nH]c2c(cc1Nc1cccc(OC(F)(F)F)c1)=NCN=2
InChIInChI=1S/C18H15N5O.C14H11F3N4O2.C14H13FN4O.C14H14N4O.C13H9F3N4O2.C13H11FN4O.C13H12N4O/c1-11-2-3-13(9-19-11)12-4-6-14(7-5-12)22-16-8-15-17(21-10-20-15)23-18(16)24;1-22-13-11(6-10-12(21-13)19-7-18-10)20-8-2-4-9(5-3-8)23-14(15,16)17;1-8-3-4-10(9(15)5-8)18-12-6-11-13(17-7-16-11)19-14(12)20-2;1-9-4-3-5-10(6-9)17-12-7-11-13(16-8-15-11)18-14(12)19-2;14-13(15,16)22-8-3-1-2-7(4-8)19-10-5-9-11(18-6-17-9)20-12(10)21;1-7-2-3-8(4-9(7)14)17-11-5-10-12(16-6-15-10)18-13(11)19;1-8-3-2-4-9(5-8)16-11-6-10-12(15-7-14-10)17-13(11)18/h2-9,22H,10H2,1H3,(H,21,23,24);2-6,20H,7H2,1H3;3-6,18H,7H2,1-2H3;3-7,17H,8H2,1-2H3;1-5,19H,6H2,(H,18,20,21);2-5,17H,6H2,1H3,(H,16,18,19);2-6,16H,7H2,1H3,(H,15,17,18)
InChIKeyLEWYYOJBQRVIQF-UHFFFAOYSA-N
MW1976.95 g/mol
LogP9.13
Rot. Bonds20

About 6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one

6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one (PubChem CID 159330374) has the molecular formula C99H85F8N29O9 and a molecular weight of 1976.95 g/mol. Its IUPAC name is 6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one.

Molecular Properties

Compound Name6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one
PubChem CID159330374
Molecular FormulaC99H85F8N29O9
Molecular Weight1976.95 g/mol
Exact Mass1975.70
IUPAC Name6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one
SMILESCOc1nc2c(cc1Nc1ccc(C)cc1F)=NCN=2.COc1nc2c(cc1Nc1ccc(OC(F)(F)F)cc1)=NCN=2.COc1nc2c(cc1Nc1cccc(C)c1)=NCN=2.Cc1ccc(-c2ccc(Nc3cc4c([nH]c3=O)=NCN=4)cc2)cn1.Cc1ccc(Nc2cc3c([nH]c2=O)=NCN=3)cc1F.Cc1cccc(Nc2cc3c([nH]c2=O)=NCN=3)c1.O=c1[nH]c2c(cc1Nc1cccc(OC(F)(F)F)c1)=NCN=2
InChIInChI=1S/C18H15N5O.C14H11F3N4O2.C14H13FN4O.C14H14N4O.C13H9F3N4O2.C13H11FN4O.C13H12N4O/c1-11-2-3-13(9-19-11)12-4-6-14(7-5-12)22-16-8-15-17(21-10-20-15)23-18(16)24;1-22-13-11(6-10-12(21-13)19-7-18-10)20-8-2-4-9(5-3-8)23-14(15,16)17;1-8-3-4-10(9(15)5-8)18-12-6-11-13(17-7-16-11)19-14(12)20-2;1-9-4-3-5-10(6-9)17-12-7-11-13(16-8-15-11)18-14(12)19-2;14-13(15,16)22-8-3-1-2-7(4-8)19-10-5-9-11(18-6-17-9)20-12(10)21;1-7-2-3-8(4-9(7)14)17-11-5-10-12(16-6-15-10)18-13(11)19;1-8-3-2-4-9(5-8)16-11-6-10-12(15-7-14-10)17-13(11)18/h2-9,22H,10H2,1H3,(H,21,23,24);2-6,20H,7H2,1H3;3-6,18H,7H2,1-2H3;3-7,17H,8H2,1-2H3;1-5,19H,6H2,(H,18,20,21);2-5,17H,6H2,1H3,(H,16,18,19);2-6,16H,7H2,1H3,(H,15,17,18)
InChIKeyLEWYYOJBQRVIQF-UHFFFAOYSA-N
XLogP9.13
TPSA486.40 Ų
H-Bond Donors11
H-Bond Acceptors34
Rotatable Bonds20
Heavy Atoms145
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001976.95
LogP ≤ 59.13
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1034

Analyze 6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one?
The IUPAC name of 6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one (CID 159330374) is 6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one.
What is the SMILES notation for 6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one?
The canonical SMILES for 6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one is COc1nc2c(cc1Nc1ccc(C)cc1F)=NCN=2.COc1nc2c(cc1Nc1ccc(OC(F)(F)F)cc1)=NCN=2.COc1nc2c(cc1Nc1cccc(C)c1)=NCN=2.Cc1ccc(-c2ccc(Nc3cc4c([nH]c3=O)=NCN=4)cc2)cn1.Cc1ccc(Nc2cc3c([nH]c2=O)=NCN=3)cc1F.Cc1cccc(Nc2cc3c([nH]c2=O)=NCN=3)c1.O=c1[nH]c2c(cc1Nc1cccc(OC(F)(F)F)c1)=NCN=2.
What is the InChIKey of 6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one?
The InChIKey is LEWYYOJBQRVIQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O.C14H11F3N4O2.C14H13FN4O.C14H14N4O.C13H9F3N4O2.C13H11FN4O.C13H12N4O/c1-11-2-3-13(9-19-11)12-4-6-14(7-5-12)22-16-8-15-17(21-10-20-15)23-18(16)24;1-22-13-11(6-10-12(21-13)19-7-18-10)20-8-2-4-9(5-3-8)23-14(15,16)17;1-8-3-4-10(9(15)5-8)18-12-6-11-13(17-7-16-11)19-14(12)20-2;1-9-4-3-5-10(6-9)17-12-7-11-13(16-8-15-11)18-14(12)19-2;14-13(15,16)22-8-3-1-2-7(4-8)19-10-5-9-11(18-6-17-9)20-12(10)21;1-7-2-3-8(4-9(7)14)17-11-5-10-12(16-6-15-10)18-13(11)19;1-8-3-2-4-9(5-8)16-11-6-10-12(15-7-14-10)17-13(11)18/h2-9,22H,10H2,1H3,(H,21,23,24);2-6,20H,7H2,1H3;3-6,18H,7H2,1-2H3;3-7,17H,8H2,1-2H3;1-5,19H,6H2,(H,18,20,21);2-5,17H,6H2,1H3,(H,16,18,19);2-6,16H,7H2,1H3,(H,15,17,18).
What are the key properties of 6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one?
6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one has a molecular weight of 1976.95 g/mol, XLogP of 9.13, 20 rotatable bonds, 11 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluoro-4-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;N-(2-fluoro-4-methylphenyl)-5-methoxy-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-(3-methylphenyl)-2H-imidazo[4,5-b]pyridin-6-amine;5-methoxy-N-[4-(trifluoromethoxy)phenyl]-2H-imidazo[4,5-b]pyridin-6-amine;6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[4-(6-methyl-3-pyridinyl)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one;6-[3-(trifluoromethoxy)anilino]-2,4-dihydroimidazo[4,5-b]pyridin-5-one is sourced from PubChem (CID 159330374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).