5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine

C142H197N69O5S3 — CID 158145684

IUPAC5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine
SMILESCC(C)n1cnc(C(N)=O)c1N.CC(C)n1cnc2c(=O)[nH]cnc21.CC(C)n1cnc2c(=S)nc[nH]c21.CC(C)n1cnc2c(N)ncnc21.CC(C)n1nnc2c(N)ncnc21.CNc1ccnc2c1ncn2C(C)C.CSc1ccnc2c1ncn2C(C)C.CSc1nc(C)nc2c1ncn2C(C)C.Cc1cn(C(C)C)c2ncnc(N)c12.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc2c(c(C)cn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(nnn2C(C)C)c(=O)[nH]1.Cc1ncc2ncn(C(C)C)c2n1
InChIInChI=1S/C11H15N3O.C10H14N4S.2C10H14N4.C10H13N3S.3C9H13N5.C9H12N4O.C9H12N4.C8H11N5O.C8H11N5.C8H10N4O.C8H10N4S.C7H10N6.C7H12N4O/c1-6(2)14-5-7(3)9-10(14)12-8(4)13-11(9)15;1-6(2)14-5-11-8-9(14)12-7(3)13-10(8)15-4;1-6(2)14-4-7(3)8-9(11)12-5-13-10(8)14;1-7(2)14-6-13-9-8(11-3)4-5-12-10(9)14;1-7(2)13-6-12-9-8(14-3)4-5-11-10(9)13;3*1-5(2)14-4-11-7-8(10)12-6(3)13-9(7)14;1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-6(2)13-5-11-8-4-10-7(3)12-9(8)13;1-4(2)13-7-6(11-12-13)8(14)10-5(3)9-7;1-5(2)13-4-12-6-7(9)10-3-11-8(6)13;2*1-5(2)12-4-11-6-7(12)9-3-10-8(6)13;1-4(2)13-7-5(11-12-13)6(8)9-3-10-7;1-4(2)11-3-10-5(6(11)8)7(9)12/h5-6H,1-4H3,(H,12,13,15);5-6H,1-4H3;4-6H,1-3H3,(H2,11,12,13);4-7H,1-3H3,(H,11,12);4-7H,1-3H3;3*4-5H,1-3H3,(H2,10,12,13);4-5H,1-3H3,(H,11,12,14);4-6H,1-3H3;4H,1-3H3,(H,9,10,14);3-5H,1-2H3,(H2,9,10,11);2*3-5H,1-2H3,(H,9,10,13);3-4H,1-2H3,(H2,8,9,10);3-4H,8H2,1-2H3,(H2,9,12)
InChIKeyFUMHYGDALQZPQD-UHFFFAOYSA-N
MW3046.82 g/mol
LogP22.36
Rot. Bonds20

About 5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine

5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine (PubChem CID 158145684) has the molecular formula C142H197N69O5S3 and a molecular weight of 3046.82 g/mol. Its IUPAC name is 5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine.

Molecular Properties

Compound Name5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine
PubChem CID158145684
Molecular FormulaC142H197N69O5S3
Molecular Weight3046.82 g/mol
Exact Mass3044.64
IUPAC Name5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine
SMILESCC(C)n1cnc(C(N)=O)c1N.CC(C)n1cnc2c(=O)[nH]cnc21.CC(C)n1cnc2c(=S)nc[nH]c21.CC(C)n1cnc2c(N)ncnc21.CC(C)n1nnc2c(N)ncnc21.CNc1ccnc2c1ncn2C(C)C.CSc1ccnc2c1ncn2C(C)C.CSc1nc(C)nc2c1ncn2C(C)C.Cc1cn(C(C)C)c2ncnc(N)c12.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc2c(c(C)cn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(nnn2C(C)C)c(=O)[nH]1.Cc1ncc2ncn(C(C)C)c2n1
InChIInChI=1S/C11H15N3O.C10H14N4S.2C10H14N4.C10H13N3S.3C9H13N5.C9H12N4O.C9H12N4.C8H11N5O.C8H11N5.C8H10N4O.C8H10N4S.C7H10N6.C7H12N4O/c1-6(2)14-5-7(3)9-10(14)12-8(4)13-11(9)15;1-6(2)14-5-11-8-9(14)12-7(3)13-10(8)15-4;1-6(2)14-4-7(3)8-9(11)12-5-13-10(8)14;1-7(2)14-6-13-9-8(11-3)4-5-12-10(9)14;1-7(2)13-6-12-9-8(14-3)4-5-11-10(9)13;3*1-5(2)14-4-11-7-8(10)12-6(3)13-9(7)14;1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-6(2)13-5-11-8-4-10-7(3)12-9(8)13;1-4(2)13-7-6(11-12-13)8(14)10-5(3)9-7;1-5(2)13-4-12-6-7(9)10-3-11-8(6)13;2*1-5(2)12-4-11-6-7(12)9-3-10-8(6)13;1-4(2)13-7-5(11-12-13)6(8)9-3-10-7;1-4(2)11-3-10-5(6(11)8)7(9)12/h5-6H,1-4H3,(H,12,13,15);5-6H,1-4H3;4-6H,1-3H3,(H2,11,12,13);4-7H,1-3H3,(H,11,12);4-7H,1-3H3;3*4-5H,1-3H3,(H2,10,12,13);4-5H,1-3H3,(H,11,12,14);4-6H,1-3H3;4H,1-3H3,(H,9,10,14);3-5H,1-2H3,(H2,9,10,11);2*3-5H,1-2H3,(H,9,10,13);3-4H,1-2H3,(H2,8,9,10);3-4H,8H2,1-2H3,(H2,9,12)
InChIKeyFUMHYGDALQZPQD-UHFFFAOYSA-N
XLogP22.36
TPSA966.08 Ų
H-Bond Donors14
H-Bond Acceptors71
Rotatable Bonds20
Heavy Atoms219
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003046.82
LogP ≤ 522.36
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1071

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze 5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)ethyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-d]pyrimidine-4-carboxamide
CID 159322771
4-N-cyclopropyl-4-N,1-dimethyl-5-N-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyrazole-4,5-dicarboxamide;1-methyl-N-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-4-(pyrrolidine-1-carbonyl)pyrazole-5-carboxamide
CID 89464826
2-amino-1-methyl-9-propan-2-ylpurin-6-one;2-amino-3-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-one;4-(dimethylamino)-1-propan-2-ylpyrimidin-2-one;bis(N,N-dimethyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);N,N-dimethyl-9-propan-2-ylpurin-6-amine;1,3-dimethyl-6-propan-2-ylpyrimidine-2,4-dione;2,3-dimethyl-1-propan-2-yl-2H-pyrimidin-4-one;N,N-dimethyl-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;N,N-dimethyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;4-(methylamino)-1-propan-2-ylpyrimidin-2-one;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;N-methyl-9-propan-2-ylpurin-6-amine;1-methyl-9-propan-2-ylpurin-6-one;1-methyl-6-propan-2-ylpyridine-2,4-dione;N-methyl-1-propan-2-ylpyrrolo[2,3-b]pyridin-4-amine;N-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-one;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine
CID 157077343
8-amino-N-butyl-N-methyl-2-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide;8-amino-N-methyl-2-(5-methylthiophen-2-yl)-N-(2-phenylethyl)-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide;8-amino-N-methyl-2-(5-methylthiophen-2-yl)-N-propyl-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide;[8-amino-2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-(3-methylpiperidin-1-yl)methanone;[8-amino-2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-thiomorpholin-4-ylmethanone;[8-amino-2-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-(3-methylpiperidin-1-yl)methanone;[8-amino-2-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-(2-methylpyrrolidin-1-yl)methanone;[8-amino-2-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-pyrrolidin-1-ylmethanone
CID 157097527
(2-amino-3-pyridinyl)-[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(1,3-benzothiazol-6-yl)methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(6-imidazol-1-yl-2-pyridinyl)methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(2-methylphenyl)methanone;(3-fluoroimidazo[1,2-a]pyridin-2-yl)-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone
CID 157107307
N,N-dimethyl-9-propan-2-ylpurin-2-amine;N,N-dimethyl-9-propan-2-ylpurin-6-amine;2-fluoro-9-propan-2-yl-1H-purin-6-one;6-methyl-9-propan-2-ylpurine;6-methylsulfanyl-9-propan-2-ylpurine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;7-propan-2-yl-5H-cyclopenta[d]pyrimidin-4-amine;3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;1-propan-2-ylimidazo[4,5-c]pyridin-4-amine;9-propan-2-yl-N-propylpurin-6-amine;9-propan-2-ylpurine-2,6-diamine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;2-[(9-propan-2-ylpurin-6-yl)amino]ethanol;1-propan-2-yl-1,2,4-triazole-3-carboxamide;1-propan-2-yltriazole-4-carboxamide
CID 157133729
9-tert-butyl-2-fluoropurin-6-amine;9-tert-butyl-8-fluoropurin-6-amine;1-tert-butylimidazo[4,5-c]pyridin-4-amine;3-tert-butyl-6H-imidazo[4,5-d]pyridazin-7-one;3-tert-butyl-5-methyl-4H-imidazo[4,5-b]pyridin-7-one;1-tert-butyl-6-methyl-5H-imidazo[4,5-c]pyridin-4-one;9-tert-butyl-2-methylpurin-6-amine;9-tert-butyl-2-methyl-3H-purine-6-thione;9-tert-butyl-2-methyl-1H-purin-6-one;1-tert-butyl-6-methyltriazolo[4,5-c]pyridine;3-tert-butyl-5-methyl-6H-triazolo[4,5-d]pyrimidin-7-one;3-tert-butyltriazolo[4,5-b]pyridin-7-amine;1-tert-butyltriazolo[4,5-c]pyridin-4-amine;1-tert-butyltriazolo[4,5-c]pyridin-7-amine
CID 157172877
1-[7-(cyclopropylamino)-3-[(E)-(2-methylidene-5-oxopyrrolidin-3-ylidene)methyl]pyrazolo[1,5-a]pyrimidin-5-yl]-3-ethylurea;N-[7-(cyclopropylamino)-3-[(E)-(2-methylidene-5-oxopyrrolidin-3-ylidene)methyl]pyrazolo[1,5-a]pyrimidin-5-yl]-3-fluoropyridine-4-carboxamide;1-[7-(cyclopropylamino)-3-[(E)-(2-methylidene-5-oxopyrrolidin-3-ylidene)methyl]pyrazolo[1,5-a]pyrimidin-5-yl]-3-propan-2-ylurea;N-[7-(cyclopropylamino)-3-[(E)-(2-methylidene-5-oxopyrrolidin-3-ylidene)methyl]pyrazolo[1,5-a]pyrimidin-5-yl]pyrimidine-4-carboxamide;N-[7-(cyclopropylamino)-3-[(E)-(2-methylidene-5-oxopyrrolidin-3-ylidene)methyl]pyrazolo[1,5-a]pyrimidin-5-yl]-1,2-thiazole-4-carboxamide
CID 157210933
[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(4-methyl-2-pyridinyl)methanone;[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(6-methyl-2-pyridinyl)methanone;[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(thiadiazol-4-yl)methanone;[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(1,3-thiazol-4-yl)methanone
CID 157223866
5-(1-hydroxyethyl)-N-[(3S)-1-imidazo[1,2-a]pyrazin-8-ylpyrrolidin-3-yl]pyrimidine-2-carboxamide;N-[(3S)-1-imidazo[1,2-a]pyrazin-8-ylpyrrolidin-3-yl]-2-pyrrolidin-1-yl-1,3-thiazole-4-carboxamide;N-[(3S)-1-(6-methylimidazo[1,2-a]pyrazin-8-yl)pyrrolidin-3-yl]-1-phenylimidazole-4-carboxamide;N-[(3S)-1-(6-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)pyrrolidin-3-yl]-1-phenylimidazole-4-carboxamide
CID 157419352
5-(1-aminoethenyl)-3-propan-2-ylimidazol-4-amine;5-amino-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;4-methyl-1-propan-2-ylbenzimidazole;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;9-propan-2-ylpurine-2,6-diamine;9-propan-2-yl-1H-purin-6-one;1-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-(1-propan-2-ylpyrazol-4-yl)ethenamine;7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;bis(3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine);1-(1-propan-2-yl-1,2,4-triazol-3-yl)ethenamine;1-(1-propan-2-yltriazol-4-yl)ethenamine;2,4,5,6-tetramethyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidine;2,4,6-trimethyl-7-propan-2-yl-5H-cyclopenta[d]pyrimidine;3,4,6-trimethyl-1-propan-2-ylpyrazolo[3,4-d]pyrimidine
CID 157425035
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-ylimidazo[4,5-b]pyridin-7-amine;3-propan-2-ylimidazo[4,5-b]pyridine;3-propan-2-yl-6H-imidazo[4,5-b]pyridin-7-one;3-propan-2-yltriazolo[4,5-b]pyridin-7-amine;3-propan-2-yltriazolo[4,5-b]pyridine;3-propan-2-yl-6H-triazolo[4,5-b]pyridin-7-one
CID 157585084

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine?
The IUPAC name of 5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine (CID 158145684) is 5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine.
What is the SMILES notation for 5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine?
The canonical SMILES for 5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine is CC(C)n1cnc(C(N)=O)c1N.CC(C)n1cnc2c(=O)[nH]cnc21.CC(C)n1cnc2c(=S)nc[nH]c21.CC(C)n1cnc2c(N)ncnc21.CC(C)n1nnc2c(N)ncnc21.CNc1ccnc2c1ncn2C(C)C.CSc1ccnc2c1ncn2C(C)C.CSc1nc(C)nc2c1ncn2C(C)C.Cc1cn(C(C)C)c2ncnc(N)c12.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc2c(c(C)cn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(nnn2C(C)C)c(=O)[nH]1.Cc1ncc2ncn(C(C)C)c2n1.
What is the InChIKey of 5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine?
The InChIKey is FUMHYGDALQZPQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O.C10H14N4S.2C10H14N4.C10H13N3S.3C9H13N5.C9H12N4O.C9H12N4.C8H11N5O.C8H11N5.C8H10N4O.C8H10N4S.C7H10N6.C7H12N4O/c1-6(2)14-5-7(3)9-10(14)12-8(4)13-11(9)15;1-6(2)14-5-11-8-9(14)12-7(3)13-10(8)15-4;1-6(2)14-4-7(3)8-9(11)12-5-13-10(8)14;1-7(2)14-6-13-9-8(11-3)4-5-12-10(9)14;1-7(2)13-6-12-9-8(14-3)4-5-11-10(9)13;3*1-5(2)14-4-11-7-8(10)12-6(3)13-9(7)14;1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-6(2)13-5-11-8-4-10-7(3)12-9(8)13;1-4(2)13-7-6(11-12-13)8(14)10-5(3)9-7;1-5(2)13-4-12-6-7(9)10-3-11-8(6)13;2*1-5(2)12-4-11-6-7(12)9-3-10-8(6)13;1-4(2)13-7-5(11-12-13)6(8)9-3-10-7;1-4(2)11-3-10-5(6(11)8)7(9)12/h5-6H,1-4H3,(H,12,13,15);5-6H,1-4H3;4-6H,1-3H3,(H2,11,12,13);4-7H,1-3H3,(H,11,12);4-7H,1-3H3;3*4-5H,1-3H3,(H2,10,12,13);4-5H,1-3H3,(H,11,12,14);4-6H,1-3H3;4H,1-3H3,(H,9,10,14);3-5H,1-2H3,(H2,9,10,11);2*3-5H,1-2H3,(H,9,10,13);3-4H,1-2H3,(H2,8,9,10);3-4H,8H2,1-2H3,(H2,9,12).
What are the key properties of 5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine?
5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine has a molecular weight of 3046.82 g/mol, XLogP of 22.36, 20 rotatable bonds, 14 hydrogen bond donors, and 71 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-propan-2-ylimidazole-4-carboxamide;2,5-dimethyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;2-methyl-6-methylsulfanyl-9-propan-2-ylpurine;N-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;tris(2-methyl-9-propan-2-ylpurin-6-amine);2-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;5-methyl-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;5-methyl-3-propan-2-yl-6H-triazolo[4,5-d]pyrimidin-7-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;9-propan-2-ylpurin-6-amine;9-propan-2-yl-3H-purine-6-thione;9-propan-2-yl-1H-purin-6-one;3-propan-2-yltriazolo[4,5-d]pyrimidin-7-amine is sourced from PubChem (CID 158145684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).