2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)

C146H205ClFN67O4 — CID 157158990

IUPAC2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)
SMILESC.C.C.C.CC(C)c1ccc2c(N)ccnn12.CC(C)c1cnc2c(N)ccnn12.CC(C)c1cnn2c(=O)[nH]c(N)nc12.CC(C)c1cnn2c(N)ccnc12.CC(C)n1cc(F)c2c(N)ccnc21.CC(C)n1ccc2c(N)ccnc21.CC(C)n1cnc2c(=O)[nH]c(N)nc21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c(N)cncc21.CC(C)n1cnc2c(N)cnnc21.CC(C)n1cnc2c1N=CCC2=O.CC(C)n1nnc2c(Cl)ccnc21.CC(C)n1nnc2c(N)ccnc21.CC(C)n1nnc2c(N)ccnc21.CCOc1nc(N)nc2c1ncn2C(C)C.Cc1nc(N)c2ncn(C(C)C)c2n1
InChIInChI=1S/C10H12FN3.C10H15N5O.2C10H13N3.C9H13N5.4C9H12N4.C9H11N3O.C8H9ClN4.2C8H11N5O.3C8H11N5.4CH4/c1-6(2)14-5-7(11)9-8(12)3-4-13-10(9)14;1-4-16-9-7-8(13-10(11)14-9)15(5-12-7)6(2)3;1-7(2)13-6-4-8-9(11)3-5-12-10(8)13;1-7(2)9-3-4-10-8(11)5-6-12-13(9)10;1-5(2)14-4-11-7-8(10)12-6(3)13-9(7)14;1-6(2)13-5-12-9-7(10)3-11-4-8(9)13;1-6(2)7-5-12-13-8(10)3-4-11-9(7)13;1-6(2)13-5-12-8-7(10)3-4-11-9(8)13;1-6(2)8-5-11-9-7(10)3-4-12-13(8)9;1-6(2)12-5-11-8-7(13)3-4-10-9(8)12;1-5(2)13-8-7(11-12-13)6(9)3-4-10-8;1-4(2)13-3-10-5-6(13)11-8(9)12-7(5)14;1-4(2)5-3-10-13-6(5)11-7(9)12-8(13)14;1-5(2)13-4-10-7-6(9)3-11-12-8(7)13;2*1-5(2)13-8-7(11-12-13)6(9)3-4-10-8;;;;/h3-6H,1-2H3,(H2,12,13);5-6H,4H2,1-3H3,(H2,11,13,14);3-7H,1-2H3,(H2,11,12);3-7H,11H2,1-2H3;4-5H,1-3H3,(H2,10,12,13);2*3-6H,10H2,1-2H3;3-6H,1-2H3,(H2,10,11);3-6H,10H2,1-2H3;4-6H,3H2,1-2H3;3-5H,1-2H3;2*3-4H,1-2H3,(H3,9,11,12,14);3-5H,1-2H3,(H2,9,12);2*3-5H,1-2H3,(H2,9,10);4*1H4
InChIKeyAMDNDMHVVBMDDM-UHFFFAOYSA-N
MW3017.16 g/mol
LogP25.05
Rot. Bonds18

About 2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)

2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine) (PubChem CID 157158990) has the molecular formula C146H205ClFN67O4 and a molecular weight of 3017.16 g/mol. Its IUPAC name is 2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine).

Molecular Properties

Compound Name2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)
PubChem CID157158990
Molecular FormulaC146H205ClFN67O4
Molecular Weight3017.16 g/mol
Exact Mass3014.76
IUPAC Name2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)
SMILESC.C.C.C.CC(C)c1ccc2c(N)ccnn12.CC(C)c1cnc2c(N)ccnn12.CC(C)c1cnn2c(=O)[nH]c(N)nc12.CC(C)c1cnn2c(N)ccnc12.CC(C)n1cc(F)c2c(N)ccnc21.CC(C)n1ccc2c(N)ccnc21.CC(C)n1cnc2c(=O)[nH]c(N)nc21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c(N)cncc21.CC(C)n1cnc2c(N)cnnc21.CC(C)n1cnc2c1N=CCC2=O.CC(C)n1nnc2c(Cl)ccnc21.CC(C)n1nnc2c(N)ccnc21.CC(C)n1nnc2c(N)ccnc21.CCOc1nc(N)nc2c1ncn2C(C)C.Cc1nc(N)c2ncn(C(C)C)c2n1
InChIInChI=1S/C10H12FN3.C10H15N5O.2C10H13N3.C9H13N5.4C9H12N4.C9H11N3O.C8H9ClN4.2C8H11N5O.3C8H11N5.4CH4/c1-6(2)14-5-7(11)9-8(12)3-4-13-10(9)14;1-4-16-9-7-8(13-10(11)14-9)15(5-12-7)6(2)3;1-7(2)13-6-4-8-9(11)3-5-12-10(8)13;1-7(2)9-3-4-10-8(11)5-6-12-13(9)10;1-5(2)14-4-11-7-8(10)12-6(3)13-9(7)14;1-6(2)13-5-12-9-7(10)3-11-4-8(9)13;1-6(2)7-5-12-13-8(10)3-4-11-9(7)13;1-6(2)13-5-12-8-7(10)3-4-11-9(8)13;1-6(2)8-5-11-9-7(10)3-4-12-13(8)9;1-6(2)12-5-11-8-7(13)3-4-10-9(8)12;1-5(2)13-8-7(11-12-13)6(9)3-4-10-8;1-4(2)13-3-10-5-6(13)11-8(9)12-7(5)14;1-4(2)5-3-10-13-6(5)11-7(9)12-8(13)14;1-5(2)13-4-10-7-6(9)3-11-12-8(7)13;2*1-5(2)13-8-7(11-12-13)6(9)3-4-10-8;;;;/h3-6H,1-2H3,(H2,12,13);5-6H,4H2,1-3H3,(H2,11,13,14);3-7H,1-2H3,(H2,11,12);3-7H,11H2,1-2H3;4-5H,1-3H3,(H2,10,12,13);2*3-6H,10H2,1-2H3;3-6H,1-2H3,(H2,10,11);3-6H,10H2,1-2H3;4-6H,3H2,1-2H3;3-5H,1-2H3;2*3-4H,1-2H3,(H3,9,11,12,14);3-5H,1-2H3,(H2,9,12);2*3-5H,1-2H3,(H2,9,10);4*1H4
InChIKeyAMDNDMHVVBMDDM-UHFFFAOYSA-N
XLogP25.05
TPSA983.72 Ų
H-Bond Donors16
H-Bond Acceptors69
Rotatable Bonds18
Heavy Atoms219
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003017.16
LogP ≤ 525.05
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1069

Analyze 2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine) with MolForge

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Related Compounds

N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-1-[[6-[[3-ethyl-4-[[7-(morpholin-2-ylmethoxy)imidazo[1,2-a]pyridine-3-carbonyl]amino]indazol-1-yl]methyl]-2-pyridinyl]methyl]-7-[2-(3-fluoropyrrolidin-1-yl)ethoxy]imidazo[1,2-a]pyridin-1-ium-3-carboxamide
CID 123604695
5-amino-11-tert-butyl-N-(4-methoxy-3-pyridinyl)-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1,3,5,8-tetraene-4-carboxamide;5-amino-N-(4-cyclopropyl-3-pyridinyl)-11-propyl-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1,3,5,8-tetraene-4-carboxamide;5-amino-N-(4-methoxy-3-pyridinyl)-13,13-dimethyl-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1,3,5,8-tetraene-4-carboxamide;5-amino-11-methyl-N-[4-(2,2,2-trifluoroethoxy)-3-pyridinyl]-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1,3,5,8-tetraene-4-carboxamide
CID 158807224
5-amino-N-(5-chloro-4-methoxy-3-pyridinyl)-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1,3,5,8-tetraene-4-carboxamide;5-amino-N-(4-methoxy-3-pyridinyl)-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1,3,5,8-tetraene-4-carboxamide;5-amino-N-(4-methyl-3-pyridinyl)-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1,3,5,8-tetraene-4-carboxamide;5-amino-N-(4-propan-2-yloxy-3-pyridinyl)-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1,3,5,8-tetraene-4-carboxamide;5-amino-N-[4-(2,2,2-trifluoroethoxy)-3-pyridinyl]-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1,3,5,8-tetraene-4-carboxamide
CID 159387256
5-chloro-2-(2,2-dimethylpropyl)pyrimidine;2-[(2S)-3,3-dimethylbutan-2-yl]pyrimidine;1-(3,3-dimethylbutyl)pyrazole;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)imidazo[1,2-a]pyridine;2-(2,2-dimethylpropyl)-5-methyl-1,3,4-oxadiazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-1-methylpyrazole;2-(2,2-dimethylpropyl)-3-methylpyridine;2-(2,2-dimethylpropyl)-6-methylpyridine;3-(2,2-dimethylpropyl)pyridine;4-(2,2-dimethylpropyl)pyridine;2-(2,2-dimethylpropyl)quinoline;2-(2,2-dimethylpropyl)-6-(trifluoromethyl)pyridine;5-(2,2-dimethylpropyl)-2-(trifluoromethyl)pyridine;2-(2,2-dimethylpropyl)-4-(trifluoromethyl)pyrimidine
CID 159942201
2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-propylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 160371220
2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 161356948
2-amino-N-[4-(1-azabicyclo[2.2.2]octan-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3R)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(oxan-4-yloxy)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-oxolan-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 161894112
2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 162044128
2-amino-5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methoxy-3-pyridinyl)-5-[3-(methylamino)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-(4-methylpiperazin-1-yl)-N-(4-propan-2-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 162133841
(2R)-3-methoxy-N-[3-[2-[(3-methoxy-1-methylpyrazol-4-yl)amino]-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]-2-(4-methylpiperazin-1-yl)propanamide;(2R)-N-[3-[2-[(3-methoxy-1-methylpyrazol-4-yl)amino]-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]-4-methyl-2-(4-methylpiperazin-1-yl)pentanamide;3,3,3-trifluoro-N-[3-[2-[(3-methoxy-1-methylpyrazol-4-yl)amino]-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]-2-(4-methylpiperazin-1-yl)propanamide
CID 164130968
N-[2-[2-[6-[(2-ethyl-4-piperazin-1-ylpyrazolo[4,3-c]pyridine-7-carbonyl)amino]-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethyl]-8-fluoro-7-methoxyimidazo[1,2-a]pyridin-6-yl]-2-[2-[8-[(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)carbamoyl]-5-piperazin-1-ylimidazo[1,2-a]pyridin-2-yl]ethyl]-8-piperazin-1-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide
CID 167500963
N-[3-[2-[[1-[2-[4-[(2R)-1-[[3-[2-[(3-methoxy-1-methylpyrazol-4-yl)amino]-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]amino]-1-oxopropan-2-yl]morpholin-2-yl]ethyl]-3-methylpyrazol-4-yl]amino]-5-methylpyrimidin-4-yl]-1H-pyrrolo[2,3-c]pyridin-7-yl]-2-(4-methylpiperazin-1-yl)butanamide
CID 146497639

Frequently Asked Questions

What is the IUPAC name of 2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)?
The IUPAC name of 2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine) (CID 157158990) is 2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine).
What is the SMILES notation for 2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)?
The canonical SMILES for 2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine) is C.C.C.C.CC(C)c1ccc2c(N)ccnn12.CC(C)c1cnc2c(N)ccnn12.CC(C)c1cnn2c(=O)[nH]c(N)nc12.CC(C)c1cnn2c(N)ccnc12.CC(C)n1cc(F)c2c(N)ccnc21.CC(C)n1ccc2c(N)ccnc21.CC(C)n1cnc2c(=O)[nH]c(N)nc21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c(N)cncc21.CC(C)n1cnc2c(N)cnnc21.CC(C)n1cnc2c1N=CCC2=O.CC(C)n1nnc2c(Cl)ccnc21.CC(C)n1nnc2c(N)ccnc21.CC(C)n1nnc2c(N)ccnc21.CCOc1nc(N)nc2c1ncn2C(C)C.Cc1nc(N)c2ncn(C(C)C)c2n1.
What is the InChIKey of 2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)?
The InChIKey is AMDNDMHVVBMDDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3.C10H15N5O.2C10H13N3.C9H13N5.4C9H12N4.C9H11N3O.C8H9ClN4.2C8H11N5O.3C8H11N5.4CH4/c1-6(2)14-5-7(11)9-8(12)3-4-13-10(9)14;1-4-16-9-7-8(13-10(11)14-9)15(5-12-7)6(2)3;1-7(2)13-6-4-8-9(11)3-5-12-10(8)13;1-7(2)9-3-4-10-8(11)5-6-12-13(9)10;1-5(2)14-4-11-7-8(10)12-6(3)13-9(7)14;1-6(2)13-5-12-9-7(10)3-11-4-8(9)13;1-6(2)7-5-12-13-8(10)3-4-11-9(7)13;1-6(2)13-5-12-8-7(10)3-4-11-9(8)13;1-6(2)8-5-11-9-7(10)3-4-12-13(8)9;1-6(2)12-5-11-8-7(13)3-4-10-9(8)12;1-5(2)13-8-7(11-12-13)6(9)3-4-10-8;1-4(2)13-3-10-5-6(13)11-8(9)12-7(5)14;1-4(2)5-3-10-13-6(5)11-7(9)12-8(13)14;1-5(2)13-4-10-7-6(9)3-11-12-8(7)13;2*1-5(2)13-8-7(11-12-13)6(9)3-4-10-8;;;;/h3-6H,1-2H3,(H2,12,13);5-6H,4H2,1-3H3,(H2,11,13,14);3-7H,1-2H3,(H2,11,12);3-7H,11H2,1-2H3;4-5H,1-3H3,(H2,10,12,13);2*3-6H,10H2,1-2H3;3-6H,1-2H3,(H2,10,11);3-6H,10H2,1-2H3;4-6H,3H2,1-2H3;3-5H,1-2H3;2*3-4H,1-2H3,(H3,9,11,12,14);3-5H,1-2H3,(H2,9,12);2*3-5H,1-2H3,(H2,9,10);4*1H4.
What are the key properties of 2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine)?
2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine) has a molecular weight of 3017.16 g/mol, XLogP of 25.05, 18 rotatable bonds, 16 hydrogen bond donors, and 69 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-9-propan-2-yl-1H-purin-6-one;2-amino-8-propan-2-yl-3H-pyrazolo[1,5-a][1,3,5]triazin-4-one;7-chloro-3-propan-2-yltriazolo[4,5-b]pyridine;6-ethoxy-9-propan-2-ylpurin-2-amine;3-fluoro-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;methane;2-methyl-9-propan-2-ylpurin-6-amine;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;7-propan-2-ylimidazo[4,5-c]pyridazin-4-amine;3-propan-2-ylimidazo[4,5-c]pyridin-7-amine;3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;7-propan-2-ylpyrrolo[1,2-b]pyridazin-4-amine;1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;bis(3-propan-2-yltriazolo[4,5-b]pyridin-7-amine) is sourced from PubChem (CID 157158990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).