About 3-(1-benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-chlorothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-[3-(dimethylamino)phenyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-fluoro-5-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-methoxy-3,5-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(6-methoxynaphthalen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-propoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
3-(1-benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-chlorothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-[3-(dimethylamino)phenyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-fluoro-5-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-methoxy-3,5-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(6-methoxynaphthalen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-propoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine (PubChem CID 161024598) has the molecular formula C164H169Cl2FN64O8S2
and a molecular weight of 3318.63 g/mol. Its IUPAC name is 3-(1-benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-chlorothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-[3-(dimethylamino)phenyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-fluoro-5-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-methoxy-3,5-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(6-methoxynaphthalen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-propoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine.
Frequently Asked Questions
What is the IUPAC name of 3-(1-benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-chlorothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-[3-(dimethylamino)phenyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-fluoro-5-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-methoxy-3,5-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(6-methoxynaphthalen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-propoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine?
The IUPAC name of 3-(1-benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-chlorothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-[3-(dimethylamino)phenyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-fluoro-5-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-methoxy-3,5-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(6-methoxynaphthalen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-propoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine (CID 161024598) is 3-(1-benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-chlorothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-[3-(dimethylamino)phenyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-fluoro-5-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-methoxy-3,5-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(6-methoxynaphthalen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-propoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 3-(1-benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-chlorothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-[3-(dimethylamino)phenyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-fluoro-5-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-methoxy-3,5-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(6-methoxynaphthalen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-propoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 3-(1-benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-chlorothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-[3-(dimethylamino)phenyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-fluoro-5-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-methoxy-3,5-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(6-methoxynaphthalen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-propoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine is CC(C)Oc1ccc(-c2nn(C)c3ncnc(N)c23)cc1Cl.CC(C)Oc1ccc(F)c(-c2nn(C)c3ncnc(N)c23)c1.CCCOc1cccc(-c2nn(C)c3ncnc(N)c23)c1.CCOc1ccc(-c2nn(C)c3ncnc(N)c23)cc1.CCOc1cccc(-c2nn(C)c3ncnc(N)c23)c1.CN(C)c1cccc(-c2nn(C)c3ncnc(N)c23)c1.COc1c(C)cc(-c2nn(C)c3ncnc(N)c23)cc1C.COc1ccc2cc(-c3nn(C)c4ncnc(N)c34)ccc2c1.Cc1noc(C)c1-c1nn(C)c2ncnc(N)c12.Cn1cc(-c2nn(C)c3ncnc(N)c23)cn1.Cn1nc(-c2cc3ccccc3s2)c2c(N)ncnc21.Cn1nc(-c2ccc(Cl)s2)c2c(N)ncnc21.
What is the InChIKey of 3-(1-benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-chlorothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-[3-(dimethylamino)phenyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-fluoro-5-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-methoxy-3,5-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(6-methoxynaphthalen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-propoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine?
The InChIKey is TYUWCOIVMHVNNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O.C15H16ClN5O.C15H16FN5O.2C15H17N5O.C14H16N6.2C14H15N5O.C14H11N5S.C11H12N6O.C10H8ClN5S.C10H11N7/c1-22-17-14(16(18)19-9-20-17)15(21-22)12-4-3-11-8-13(23-2)6-5-10(11)7-12;1-8(2)22-11-5-4-9(6-10(11)16)13-12-14(17)18-7-19-15(12)21(3)20-13;1-8(2)22-9-4-5-11(16)10(6-9)13-12-14(17)18-7-19-15(12)21(3)20-13;1-8-5-10(6-9(2)13(8)21-4)12-11-14(16)17-7-18-15(11)20(3)19-12;1-3-7-21-11-6-4-5-10(8-11)13-12-14(16)17-9-18-15(12)20(2)19-13;1-19(2)10-6-4-5-9(7-10)12-11-13(15)16-8-17-14(11)20(3)18-12;1-3-20-10-6-4-9(5-7-10)12-11-13(15)16-8-17-14(11)19(2)18-12;1-3-20-10-6-4-5-9(7-10)12-11-13(15)16-8-17-14(11)19(2)18-12;1-19-14-11(13(15)16-7-17-14)12(18-19)10-6-8-4-2-3-5-9(8)20-10;1-5-7(6(2)18-16-5)9-8-10(12)13-4-14-11(8)17(3)15-9;1-16-10-7(9(12)13-4-14-10)8(15-16)5-2-3-6(11)17-5;1-16-4-6(3-14-16)8-7-9(11)12-5-13-10(7)17(2)15-8/h3-9H,1-2H3,(H2,18,19,20);2*4-8H,1-3H3,(H2,17,18,19);5-7H,1-4H3,(H2,16,17,18);4-6,8-9H,3,7H2,1-2H3,(H2,16,17,18);4-8H,1-3H3,(H2,15,16,17);2*4-8H,3H2,1-2H3,(H2,15,16,17);2-7H,1H3,(H2,15,16,17);4H,1-3H3,(H2,12,13,14);2-4H,1H3,(H2,12,13,14);3-5H,1-2H3,(H2,11,12,13).
What are the key properties of 3-(1-benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-chlorothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-[3-(dimethylamino)phenyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-fluoro-5-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-methoxy-3,5-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(6-methoxynaphthalen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-propoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine?
3-(1-benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-chlorothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-[3-(dimethylamino)phenyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-fluoro-5-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-methoxy-3,5-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(6-methoxynaphthalen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-propoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine has a molecular weight of 3318.63 g/mol, XLogP of 25.42, 26 rotatable bonds, 12 hydrogen bond donors, and 74 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(5-chlorothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-[3-(dimethylamino)phenyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-ethoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(2-fluoro-5-propan-2-yloxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(4-methoxy-3,5-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(6-methoxynaphthalen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-propoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 161024598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).