6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine

C84H105N35O8 — CID 163517349

IUPAC6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine
SMILESC=C1Cn2c(nc3c(ncn3C(C)C)c2=O)N1.CC(C)n1ccc(=O)c2nccn21.CC(C)n1ccc(=O)n2ccnc12.CC(C)n1cnc2c(=O)[nH]c(N)cc21.CC(C)n1cnc2c(=O)n3ccnc3[nH]c21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c1C=CCC2=O.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(nnn2C(C)C)c(=O)[nH]1
InChIInChI=1S/C11H13N5O.C10H11N5O.C10H12N2O.2C9H12N4O.C9H12N4.2C9H11N3O.C8H11N5O/c1-6(2)16-5-12-8-9(16)14-11-13-7(3)4-15(11)10(8)17;1-6(2)15-5-12-7-8(15)13-10-11-3-4-14(10)9(7)16;1-7(2)12-6-11-10-8(12)4-3-5-9(10)13;1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-5(2)13-4-11-8-6(13)3-7(10)12-9(8)14;1-6(2)13-5-12-8-7(10)3-4-11-9(8)13;1-7(2)11-5-3-8(13)12-6-4-10-9(11)12;1-7(2)11-5-3-8(13)9-10-4-6-12(9)11;1-4(2)13-7-6(11-12-13)8(14)10-5(3)9-7/h5-6H,3-4H2,1-2H3,(H,13,14);3-6H,1-2H3,(H,11,13);3-4,6-7H,5H2,1-2H3;4-5H,1-3H3,(H,11,12,14);3-5H,1-2H3,(H3,10,12,14);3-6H,1-2H3,(H2,10,11);2*3-7H,1-2H3;4H,1-3H3,(H,9,10,14)
InChIKeyDHWDPEUGRCFKCD-UHFFFAOYSA-N
MW1733.00 g/mol
LogP10.18
Rot. Bonds9

About 6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine

6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine (PubChem CID 163517349) has the molecular formula C84H105N35O8 and a molecular weight of 1733.00 g/mol. Its IUPAC name is 6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine.

Molecular Properties

Compound Name6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine
PubChem CID163517349
Molecular FormulaC84H105N35O8
Molecular Weight1733.00 g/mol
Exact Mass1731.89
IUPAC Name6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine
SMILESC=C1Cn2c(nc3c(ncn3C(C)C)c2=O)N1.CC(C)n1ccc(=O)c2nccn21.CC(C)n1ccc(=O)n2ccnc12.CC(C)n1cnc2c(=O)[nH]c(N)cc21.CC(C)n1cnc2c(=O)n3ccnc3[nH]c21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c1C=CCC2=O.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(nnn2C(C)C)c(=O)[nH]1
InChIInChI=1S/C11H13N5O.C10H11N5O.C10H12N2O.2C9H12N4O.C9H12N4.2C9H11N3O.C8H11N5O/c1-6(2)16-5-12-8-9(16)14-11-13-7(3)4-15(11)10(8)17;1-6(2)15-5-12-7-8(15)13-10-11-3-4-14(10)9(7)16;1-7(2)12-6-11-10-8(12)4-3-5-9(10)13;1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-5(2)13-4-11-8-6(13)3-7(10)12-9(8)14;1-6(2)13-5-12-8-7(10)3-4-11-9(8)13;1-7(2)11-5-3-8(13)12-6-4-10-9(11)12;1-7(2)11-5-3-8(13)9-10-4-6-12(9)11;1-4(2)13-7-6(11-12-13)8(14)10-5(3)9-7/h5-6H,3-4H2,1-2H3,(H,13,14);3-6H,1-2H3,(H,11,13);3-4,6-7H,5H2,1-2H3;4-5H,1-3H3,(H,11,12,14);3-5H,1-2H3,(H3,10,12,14);3-6H,1-2H3,(H2,10,11);2*3-7H,1-2H3;4H,1-3H3,(H,9,10,14)
InChIKeyDHWDPEUGRCFKCD-UHFFFAOYSA-N
XLogP10.18
TPSA519.67 Ų
H-Bond Donors7
H-Bond Acceptors39
Rotatable Bonds9
Heavy Atoms127
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001733.00
LogP ≤ 510.18
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1039

Analyze 6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine with MolForge

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Launch Full Analysis

Related Compounds

3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purine-6,9-dione;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;1-propan-2-yl-5H-pyrrolo[2,1-b]purin-4-one;1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one
CID 158794257
2-amino-9-propan-2-yl-1H-purin-6-one;5-fluoro-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-fluoro-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purine-6,9-dione;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;7-propan-2-ylimidazo[2,1-f][1,2,4]triazin-4-amine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-1H-purin-6-one;1-propan-2-yl-5H-pyrrolo[2,1-b]purin-4-one;7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;3-propan-2-yltriazolo[4,5-b]pyridin-7-amine;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine
CID 163507427
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
8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-fluoro-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;methane;11-methylidene-6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-trien-2-one;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;tris(2-methyl-9-propan-2-ylpurin-6-amine);tris(2-methyl-9-propan-2-yl-1H-purin-6-one);2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;bis(1-propan-2-ylbenzimidazol-4-amine);7-propan-2-yl-5H-cyclopenta[b]pyridin-4-amine;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-yl-6H-imidazo[4,5-c]pyridin-7-one;1-propan-2-yl-5H-pyrrolo[2,1-b]purin-4-one;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyridin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine
CID 163505489
3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;11-methylidene-6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-trien-2-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;1-propan-2-yl-5H-pyrrolo[2,1-b]purin-4-one;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;6-propan-2-yl-1,6,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,9,11-tetraen-2-one
CID 163971887
3-fluoro-1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one;1-propan-2-yl-5,9a-dihydro-3aH-imidazo[2,1-b]purin-4-one;1-propan-2-ylbenzimidazol-4-amine;7-propan-2-yl-5H-cyclopenta[d]pyrimidin-4-amine;3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purine-6,9-dione;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;1-propan-2-ylimidazo[4,5-c]pyridin-4-amine;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one
CID 163915195
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;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;9-propan-2-yl-1H-purin-6-one;1-propan-2-yl-5H-pyrrolo[2,1-b]purin-4-one;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;1-propan-2-yl-5H-pyrrolo[2,3-b]pyridin-4-one
CID 162132124
2-methyl-9-propan-2-yl-1H-purin-6-one;9-propan-2-ylpurin-6-amine;3-propan-2-yltriazolo[4,5-b]pyridin-7-amine
CID 161469986
6-chloro-9-propan-2-ylpurine;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;bis(2-methyl-9-propan-2-ylpurin-6-amine);bis(2-methyl-9-propan-2-yl-1H-purin-6-one);2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;3-propan-2-yl-6H-imidazo[4,5-d]pyridazin-7-one
CID 159922589
2-amino-1,7-dihydropurin-6-one;6-ethynoxy-9-propan-2-ylpurin-2-amine;2-methylpropane;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one
CID 167533129
2-amino-9-propan-2-yl-1H-purin-6-one;9-propan-2-ylpurin-6-amine;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine
CID 160504093
4-chloro-1-propan-2-ylpyrrolo[2,3-b]pyridine;7-ethyl-3-propan-2-ylimidazo[4,5-b]pyridine;3-isocyano-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;7-(2-methoxyethyl)-3-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;6-methyl-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;2-methyl-9-propan-2-ylpurine;2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;1-propan-2-ylbenzotriazol-4-amine;7-propan-2-yl-3,5-dihydropyrrolo[3,4-b]pyridin-4-one;3-propan-2-ylimidazo[4,5-b]pyridine;3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;9-propan-2-ylpurine-6-carboxamide
CID 160579347

Frequently Asked Questions

What is the IUPAC name of 6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine?
The IUPAC name of 6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine (CID 163517349) is 6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine.
What is the SMILES notation for 6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine?
The canonical SMILES for 6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine is C=C1Cn2c(nc3c(ncn3C(C)C)c2=O)N1.CC(C)n1ccc(=O)c2nccn21.CC(C)n1ccc(=O)n2ccnc12.CC(C)n1cnc2c(=O)[nH]c(N)cc21.CC(C)n1cnc2c(=O)n3ccnc3[nH]c21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c1C=CCC2=O.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(nnn2C(C)C)c(=O)[nH]1.
What is the InChIKey of 6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine?
The InChIKey is DHWDPEUGRCFKCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O.C10H11N5O.C10H12N2O.2C9H12N4O.C9H12N4.2C9H11N3O.C8H11N5O/c1-6(2)16-5-12-8-9(16)14-11-13-7(3)4-15(11)10(8)17;1-6(2)15-5-12-7-8(15)13-10-11-3-4-14(10)9(7)16;1-7(2)12-6-11-10-8(12)4-3-5-9(10)13;1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-5(2)13-4-11-8-6(13)3-7(10)12-9(8)14;1-6(2)13-5-12-8-7(10)3-4-11-9(8)13;1-7(2)11-5-3-8(13)12-6-4-10-9(11)12;1-7(2)11-5-3-8(13)9-10-4-6-12(9)11;1-4(2)13-7-6(11-12-13)8(14)10-5(3)9-7/h5-6H,3-4H2,1-2H3,(H,13,14);3-6H,1-2H3,(H,11,13);3-4,6-7H,5H2,1-2H3;4-5H,1-3H3,(H,11,12,14);3-5H,1-2H3,(H3,10,12,14);3-6H,1-2H3,(H2,10,11);2*3-7H,1-2H3;4H,1-3H3,(H,9,10,14).
What are the key properties of 6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine?
6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine has a molecular weight of 1733.00 g/mol, XLogP of 10.18, 9 rotatable bonds, 7 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;6-methylidene-3-propan-2-yl-5,7-dihydroimidazo[1,2-a]purin-9-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;1-propan-2-yl-5H-benzimidazol-4-one;3-propan-2-yl-4H-imidazo[1,2-a]purin-9-one;8-propan-2-ylimidazo[1,2-a]pyrimidin-5-one;5-propan-2-ylimidazo[1,2-b]pyridazin-8-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine is sourced from PubChem (CID 163517349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).