About 3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[1,2-a]triazin-9-ium-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-yl-1,3,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)
3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[1,2-a]triazin-9-ium-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-yl-1,3,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine) (PubChem CID 163532118) has the molecular formula C167H209F2N68O12+
and a molecular weight of 3398.97 g/mol. Its IUPAC name is 3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[1,2-a]triazin-9-ium-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-yl-1,3,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine).
Frequently Asked Questions
What is the IUPAC name of 3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[1,2-a]triazin-9-ium-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-yl-1,3,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)?
The IUPAC name of 3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[1,2-a]triazin-9-ium-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-yl-1,3,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine) (CID 163532118) is 3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[1,2-a]triazin-9-ium-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-yl-1,3,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine).
What is the SMILES notation for 3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[1,2-a]triazin-9-ium-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-yl-1,3,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)?
The canonical SMILES for 3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[1,2-a]triazin-9-ium-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-yl-1,3,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine) is C=C1Cn2c(nc3c(ncn3C(C)C)c2=O)N1.CC(C)c1cnc2c(N)ccnn12.CC(C)n1cc(F)c2c(N)ccnc21.CC(C)n1cc(F)c2c1N=CCC2=O.CC(C)n1ccc(=O)n2ccc[n+]12.CC(C)n1ccc(=O)n2ccnc12.CC(C)n1ccc2c(=O)[nH]c3nccn3c21.CC(C)n1ccc2c(=O)n3ccnc3[nH]c21.CC(C)n1ccc2c(N)ncnc21.CC(C)n1cnc2c(=O)[nH]ccc21.CC(C)n1cnc2c(=O)[nH]cnc21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c1N=CCC2=O.CC(C)n1nnc2c(N)ccnc21.CC(C)n1nnc2c(N)ccnc21.Cc1cc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(nnn2C(C)C)c(=O)[nH]1.
What is the InChIKey of 3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[1,2-a]triazin-9-ium-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-yl-1,3,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)?
The InChIKey is KBDWWYRFEPZTQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O.2C11H12N4O.C10H12FN3.C10H11FN2O.C10H13N3O.C9H12N4O.3C9H12N4.C9H11N3O.C9H12N3O.2C9H11N3O.C8H11N5O.2C8H11N5.C8H10N4O/c1-6(2)16-5-12-8-9(16)14-11-13-7(3)4-15(11)10(8)17;1-7(2)14-5-3-8-9(16)13-11-12-4-6-15(11)10(8)14;1-7(2)14-5-3-8-9(14)13-11-12-4-6-15(11)10(8)16;1-6(2)14-5-7(11)9-8(12)3-4-13-10(9)14;1-6(2)13-5-7(11)9-8(14)3-4-12-10(9)13;1-6(2)13-5-11-9-8(13)4-7(3)12-10(9)14;1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-6(2)13-5-12-8-7(10)3-4-11-9(8)13;1-6(2)13-4-3-7-8(10)11-5-12-9(7)13;1-6(2)8-5-11-9-7(10)3-4-12-13(8)9;1-7(2)11-5-3-8(13)12-6-4-10-9(11)12;1-8(2)10-7-4-9(13)11-5-3-6-12(10)11;1-6(2)12-5-11-8-7(13)3-4-10-9(8)12;1-6(2)12-5-11-8-7(12)3-4-10-9(8)13;1-4(2)13-7-6(11-12-13)8(14)10-5(3)9-7;2*1-5(2)13-8-7(11-12-13)6(9)3-4-10-8;1-5(2)12-4-11-6-7(12)9-3-10-8(6)13/h5-6H,3-4H2,1-2H3,(H,13,14);3-7H,1-2H3,(H,12,13,16);3-7H,1-2H3,(H,12,13);3-6H,1-2H3,(H2,12,13);4-6H,3H2,1-2H3;4-6H,1-3H3,(H,12,14);4-5H,1-3H3,(H,11,12,14);3-6H,1-2H3,(H2,10,11);3-6H,1-2H3,(H2,10,11,12);3-6H,10H2,1-2H3;3-7H,1-2H3;3-8H,1-2H3;4-6H,3H2,1-2H3;3-6H,1-2H3,(H,10,13);4H,1-3H3,(H,9,10,14);2*3-5H,1-2H3,(H2,9,10);3-5H,1-2H3,(H,9,10,13)/q;;;;;;;;;;;+1;;;;;;.
What are the key properties of 3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[1,2-a]triazin-9-ium-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-yl-1,3,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)?
3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[1,2-a]triazin-9-ium-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-yl-1,3,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine) has a molecular weight of 3398.97 g/mol, XLogP of 23.80, 18 rotatable bonds, 14 hydrogen bond donors, and 72 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;3-propan-2-ylimidazo[1,2-b]pyridazin-8-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[1,2-a]triazin-9-ium-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-yl-1,3,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine) is sourced from PubChem (CID 163532118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).