6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine

C124H104ClF2N59O3S2 — CID 157410001

IUPAC6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine
SMILESCC(F)Oc1cccc(-n2ncc3c(N)ncnc32)c1.COc1cccc(-n2ncc3c(N)ncnc32)c1.Cc1cc(-n2ncc3c(N)ncnc32)ccc1F.Cc1ccc(-n2ncc3c(N)ncnc32)cc1.Cc1cccc(-n2ncc3c(N)ncnc32)c1.Nc1ncnc2c1cnn2-c1ccc(Cl)cc1.Nc1ncnc2c1cnn2-c1ccc(O)cn1.Nc1ncnc2c1cnn2-c1cccc(-c2cnc[nH]2)c1.Nc1ncnc2c1cnn2-c1cccs1.Nc1ncnc2c1cnn2-c1ccncc1.Nc1ncnc2c1cnn2-c1ccsc1
InChIInChI=1S/C14H11N7.C13H12FN5O.C12H10FN5.C12H11N5O.2C12H11N5.C11H8ClN5.C10H8N6O.C10H8N6.2C9H7N5S/c15-13-11-5-20-21(14(11)19-8-18-13)10-3-1-2-9(4-10)12-6-16-7-17-12;1-8(14)20-10-4-2-3-9(5-10)19-13-11(6-18-19)12(15)16-7-17-13;1-7-4-8(2-3-10(7)13)18-12-9(5-17-18)11(14)15-6-16-12;1-18-9-4-2-3-8(5-9)17-12-10(6-16-17)11(13)14-7-15-12;1-8-2-4-9(5-3-8)17-12-10(6-16-17)11(13)14-7-15-12;1-8-3-2-4-9(5-8)17-12-10(6-16-17)11(13)14-7-15-12;12-7-1-3-8(4-2-7)17-11-9(5-16-17)10(13)14-6-15-11;11-9-7-4-15-16(10(7)14-5-13-9)8-2-1-6(17)3-12-8;11-9-8-5-15-16(10(8)14-6-13-9)7-1-3-12-4-2-7;10-8-7-3-13-14(6-1-2-15-4-6)9(7)12-5-11-8;10-8-6-4-13-14(7-2-1-3-15-7)9(6)12-5-11-8/h1-8H,(H,16,17)(H2,15,18,19);2-8H,1H3,(H2,15,16,17);2-6H,1H3,(H2,14,15,16);2-7H,1H3,(H2,13,14,15);2*2-7H,1H3,(H2,13,14,15);1-6H,(H2,13,14,15);1-5,17H,(H2,11,13,14);1-6H,(H2,11,13,14);2*1-5H,(H2,10,11,12)
InChIKeyBOEAEVRAMLWIJW-UHFFFAOYSA-N
MW2606.19 g/mol
LogP16.80
Rot. Bonds15

About 6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine

6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine (PubChem CID 157410001) has the molecular formula C124H104ClF2N59O3S2 and a molecular weight of 2606.19 g/mol. Its IUPAC name is 6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine
PubChem CID157410001
Molecular FormulaC124H104ClF2N59O3S2
Molecular Weight2606.19 g/mol
Exact Mass2603.89
IUPAC Name6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine
SMILESCC(F)Oc1cccc(-n2ncc3c(N)ncnc32)c1.COc1cccc(-n2ncc3c(N)ncnc32)c1.Cc1cc(-n2ncc3c(N)ncnc32)ccc1F.Cc1ccc(-n2ncc3c(N)ncnc32)cc1.Cc1cccc(-n2ncc3c(N)ncnc32)c1.Nc1ncnc2c1cnn2-c1ccc(Cl)cc1.Nc1ncnc2c1cnn2-c1ccc(O)cn1.Nc1ncnc2c1cnn2-c1cccc(-c2cnc[nH]2)c1.Nc1ncnc2c1cnn2-c1cccs1.Nc1ncnc2c1cnn2-c1ccncc1.Nc1ncnc2c1cnn2-c1ccsc1
InChIInChI=1S/C14H11N7.C13H12FN5O.C12H10FN5.C12H11N5O.2C12H11N5.C11H8ClN5.C10H8N6O.C10H8N6.2C9H7N5S/c15-13-11-5-20-21(14(11)19-8-18-13)10-3-1-2-9(4-10)12-6-16-7-17-12;1-8(14)20-10-4-2-3-9(5-10)19-13-11(6-18-19)12(15)16-7-17-13;1-7-4-8(2-3-10(7)13)18-12-9(5-17-18)11(14)15-6-16-12;1-18-9-4-2-3-8(5-9)17-12-10(6-16-17)11(13)14-7-15-12;1-8-2-4-9(5-3-8)17-12-10(6-16-17)11(13)14-7-15-12;1-8-3-2-4-9(5-8)17-12-10(6-16-17)11(13)14-7-15-12;12-7-1-3-8(4-2-7)17-11-9(5-16-17)10(13)14-6-15-11;11-9-7-4-15-16(10(7)14-5-13-9)8-2-1-6(17)3-12-8;11-9-8-5-15-16(10(8)14-6-13-9)7-1-3-12-4-2-7;10-8-7-3-13-14(6-1-2-15-4-6)9(7)12-5-11-8;10-8-6-4-13-14(7-2-1-3-15-7)9(6)12-5-11-8/h1-8H,(H,16,17)(H2,15,18,19);2-8H,1H3,(H2,15,16,17);2-6H,1H3,(H2,14,15,16);2-7H,1H3,(H2,13,14,15);2*2-7H,1H3,(H2,13,14,15);1-6H,(H2,13,14,15);1-5,17H,(H2,11,13,14);1-6H,(H2,11,13,14);2*1-5H,(H2,10,11,12)
InChIKeyBOEAEVRAMLWIJW-UHFFFAOYSA-N
XLogP16.80
TPSA858.97 Ų
H-Bond Donors13
H-Bond Acceptors63
Rotatable Bonds15
Heavy Atoms191
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002606.19
LogP ≤ 516.80
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1063

Analyze 6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine with MolForge

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Related Compounds

N-[[6-(3,5-difluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-7-[[(2R)-pyrrolidin-2-yl]methoxy]-1,5-naphthyridin-4-amine;7-fluoro-N-[[6-(3,4,5-trifluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-1,5-naphthyridin-4-amine;methane;[5-[3-[[(7-methoxy-1,5-naphthyridin-4-yl)amino]methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,2-thiazol-3-yl]methanol;N-[[6-(3-methyl-1,2-thiazol-5-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-1H-imidazo[4,5-b]pyridin-7-amine;N-[[6-(3,4,5-trifluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-1H-imidazo[4,5-b]pyridin-7-amine
CID 158438303
N-[[6-(3,5-difluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-7-[[(2R)-pyrrolidin-2-yl]methoxy]-1,5-naphthyridin-4-amine;N-[[6-(3,5-difluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-7-[[(2S)-pyrrolidin-2-yl]methoxy]-1,5-naphthyridin-4-amine;7-methoxy-N-[[6-(2-morpholin-4-yl-1,3-thiazol-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-1,5-naphthyridin-4-amine;N-[[6-(3-methyl-1,2-thiazol-5-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-1H-imidazo[4,5-b]pyridin-7-amine;N-[[6-(3,4,5-trifluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-3H-pyrrolo[3,2-b]pyridin-7-amine
CID 158941466
N-[4-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]thiophene-2-carboxamide;N-[4-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]thiophene-3-carboxamide;3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)-1H-pyridazin-6-one;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(difluoromethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 159131500
4-[[6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methoxy]-7-methoxyquinoline;4-[[6-(3-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methoxy]-7-methoxyquinoline;N-[(6-phenylimidazo[1,2-b]pyridazin-3-yl)methyl]thieno[3,2-b]pyridin-7-amine;2-N-phenyl-4-N-[(6-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]pyrimidine-2,4-diamine;N-[(6-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]-1H-imidazo[4,5-b]pyridin-7-amine
CID 159684368
5-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)-2-chlorophenol;[4-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)thiophen-2-yl]methanol;3-(2-aminopyrimidin-5-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(1H-indol-6-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-methoxythiophen-3-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(2-methyl-3H-benzimidazol-5-yl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 161001653
3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)-1H-pyridazin-6-one;1-(1,3-benzothiazol-2-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(difluoromethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(1H-indazol-5-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 161488486
7-chloro-5,6-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2-(1-fluoroethyl)-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-5-methyl-2,4-di(propan-2-yl)pyrrolo[2,1-f][1,2,4]triazine;7-chloro-5-methyl-2-(4-methylphenyl)-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;5-chloro-4-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;1,6-dimethyl-4-propan-2-ylpyrazolo[3,4-d]pyrimidine;1,4-di(propan-2-yl)pyrazolo[3,4-d]pyrimidine;5-fluoro-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;4-[2-(6-fluoro-4-propan-2-ylquinazolin-7-yl)oxyethyl]morpholine;2-methyl-6-propan-2-yl-7H-purine;1-methyl-4-propan-2-ylpyrazolo[3,4-d]pyrimidine;5-phenyl-4-propan-2-ylthieno[2,3-d]pyrimidine;4-(4-propan-2-ylpyrazolo[3,4-d]pyrimidin-1-yl)cyclohexan-1-ol
CID 165082882

Frequently Asked Questions

What is the IUPAC name of 6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine?
The IUPAC name of 6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine (CID 157410001) is 6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine is CC(F)Oc1cccc(-n2ncc3c(N)ncnc32)c1.COc1cccc(-n2ncc3c(N)ncnc32)c1.Cc1cc(-n2ncc3c(N)ncnc32)ccc1F.Cc1ccc(-n2ncc3c(N)ncnc32)cc1.Cc1cccc(-n2ncc3c(N)ncnc32)c1.Nc1ncnc2c1cnn2-c1ccc(Cl)cc1.Nc1ncnc2c1cnn2-c1ccc(O)cn1.Nc1ncnc2c1cnn2-c1cccc(-c2cnc[nH]2)c1.Nc1ncnc2c1cnn2-c1cccs1.Nc1ncnc2c1cnn2-c1ccncc1.Nc1ncnc2c1cnn2-c1ccsc1.
What is the InChIKey of 6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine?
The InChIKey is BOEAEVRAMLWIJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N7.C13H12FN5O.C12H10FN5.C12H11N5O.2C12H11N5.C11H8ClN5.C10H8N6O.C10H8N6.2C9H7N5S/c15-13-11-5-20-21(14(11)19-8-18-13)10-3-1-2-9(4-10)12-6-16-7-17-12;1-8(14)20-10-4-2-3-9(5-10)19-13-11(6-18-19)12(15)16-7-17-13;1-7-4-8(2-3-10(7)13)18-12-9(5-17-18)11(14)15-6-16-12;1-18-9-4-2-3-8(5-9)17-12-10(6-16-17)11(13)14-7-15-12;1-8-2-4-9(5-3-8)17-12-10(6-16-17)11(13)14-7-15-12;1-8-3-2-4-9(5-8)17-12-10(6-16-17)11(13)14-7-15-12;12-7-1-3-8(4-2-7)17-11-9(5-16-17)10(13)14-6-15-11;11-9-7-4-15-16(10(7)14-5-13-9)8-2-1-6(17)3-12-8;11-9-8-5-15-16(10(8)14-6-13-9)7-1-3-12-4-2-7;10-8-7-3-13-14(6-1-2-15-4-6)9(7)12-5-11-8;10-8-6-4-13-14(7-2-1-3-15-7)9(6)12-5-11-8/h1-8H,(H,16,17)(H2,15,18,19);2-8H,1H3,(H2,15,16,17);2-6H,1H3,(H2,14,15,16);2-7H,1H3,(H2,13,14,15);2*2-7H,1H3,(H2,13,14,15);1-6H,(H2,13,14,15);1-5,17H,(H2,11,13,14);1-6H,(H2,11,13,14);2*1-5H,(H2,10,11,12).
What are the key properties of 6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine?
6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine has a molecular weight of 2606.19 g/mol, XLogP of 16.80, 15 rotatable bonds, 13 hydrogen bond donors, and 63 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)pyridin-3-ol;1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1-fluoroethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-fluoro-3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-[3-(1H-imidazol-5-yl)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine;1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;1-thiophen-3-ylpyrazolo[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 157410001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).