2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine

C213H240Br5IN86O6 — CID 157254167

IUPAC2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCOC(=O)C(c1ccccc1)n1cc(-c2cnn3c(N)cc(C4CCCNC4)nc23)cn1.CCn1cc(-c2cnn3c(N)c(Br)c(C4CCCNC4)nc23)cn1.CN(C)C(=O)Cn1cc(-c2cnn3c(N)cc(C4CCCNC4)nc23)cn1.Cn1cc(-c2cnn3c(N)c(I)c(C4CCCNC4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4CCCN(CCO)C4)nc23)cn1.N#Cc1ccc(-c2cnn3c(N)c(Br)c(C4CCCNC4)nc23)cn1.N#Cc1ccc(-c2cnn3c(N)cc(C4CCCNC4)nc23)cn1.N#Cc1ccccc1Cn1cc(-c2cnn3c(N)cc(C4CCCNC4)nc23)cn1.N#Cc1cncc(-c2cnn3c(N)c(Br)c(C4CCCNC4)nc23)c1.Nc1c(Br)c(C2CCCNC2)nc2c(-c3cnn(CCO)c3)cnn12.Nc1c(Br)c(C2CCCNC2)nc2c(-c3cnoc3)cnn12.Nc1cc(C2CCCNC2)nc2c(-c3cnn(Cc4ccncc4)c3)cnn12
InChIInChI=1S/C24H27N7O2.C22H22N8.C20H22N8.C18H24N8O.2C17H16BrN7.C17H23N7O.C17H17N7.C16H20BrN7O.C16H20BrN7.C15H18IN7.C14H15BrN6O/c1-2-33-24(32)22(16-7-4-3-5-8-16)30-15-18(13-27-30)19-14-28-31-21(25)11-20(29-23(19)31)17-9-6-10-26-12-17;23-9-15-4-1-2-5-17(15)13-29-14-18(11-26-29)19-12-27-30-21(24)8-20(28-22(19)30)16-6-3-7-25-10-16;21-19-8-18(15-2-1-5-23-9-15)26-20-17(11-25-28(19)20)16-10-24-27(13-16)12-14-3-6-22-7-4-14;1-24(2)17(27)11-25-10-13(8-21-25)14-9-22-26-16(19)6-15(23-18(14)26)12-4-3-5-20-7-12;18-14-15(11-2-1-5-21-7-11)24-17-13(9-23-25(17)16(14)20)10-3-4-12(6-19)22-8-10;18-14-15(11-2-1-3-21-7-11)24-17-13(9-23-25(17)16(14)20)12-4-10(5-19)6-22-8-12;1-22-10-13(8-19-22)14-9-20-24-16(18)7-15(21-17(14)24)12-3-2-4-23(11-12)5-6-25;18-7-13-4-3-11(9-21-13)14-10-22-24-16(19)6-15(23-17(14)24)12-2-1-5-20-8-12;17-13-14(10-2-1-3-19-6-10)22-16-12(8-21-24(16)15(13)18)11-7-20-23(9-11)4-5-25;1-2-23-9-11(7-20-23)12-8-21-24-15(18)13(17)14(22-16(12)24)10-4-3-5-19-6-10;1-22-8-10(6-19-22)11-7-20-23-14(17)12(16)13(21-15(11)23)9-3-2-4-18-5-9;15-11-12(8-2-1-3-17-4-8)20-14-10(9-5-19-22-7-9)6-18-21(14)13(11)16/h3-5,7-8,11,13-15,17,22,26H,2,6,9-10,12,25H2,1H3;1-2,4-5,8,11-12,14,16,25H,3,6-7,10,13,24H2;3-4,6-8,10-11,13,15,23H,1-2,5,9,12,21H2;6,8-10,12,20H,3-5,7,11,19H2,1-2H3;3-4,8-9,11,21H,1-2,5,7,20H2;4,6,8-9,11,21H,1-3,7,20H2;7-10,12,25H,2-6,11,18H2,1H3;3-4,6,9-10,12,20H,1-2,5,8,19H2;7-10,19,25H,1-6,18H2;7-10,19H,2-6,18H2,1H3;6-9,18H,2-5,17H2,1H3;5-8,17H,1-4,16H2
InChIKeyAWRNLAAJOYKBHQ-UHFFFAOYSA-N
MW4627.28 g/mol
LogP23.52
Rot. Bonds39

About 2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine

2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 157254167) has the molecular formula C213H240Br5IN86O6 and a molecular weight of 4627.28 g/mol. Its IUPAC name is 2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID157254167
Molecular FormulaC213H240Br5IN86O6
Molecular Weight4627.28 g/mol
Exact Mass4619.61
IUPAC Name2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCOC(=O)C(c1ccccc1)n1cc(-c2cnn3c(N)cc(C4CCCNC4)nc23)cn1.CCn1cc(-c2cnn3c(N)c(Br)c(C4CCCNC4)nc23)cn1.CN(C)C(=O)Cn1cc(-c2cnn3c(N)cc(C4CCCNC4)nc23)cn1.Cn1cc(-c2cnn3c(N)c(I)c(C4CCCNC4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4CCCN(CCO)C4)nc23)cn1.N#Cc1ccc(-c2cnn3c(N)c(Br)c(C4CCCNC4)nc23)cn1.N#Cc1ccc(-c2cnn3c(N)cc(C4CCCNC4)nc23)cn1.N#Cc1ccccc1Cn1cc(-c2cnn3c(N)cc(C4CCCNC4)nc23)cn1.N#Cc1cncc(-c2cnn3c(N)c(Br)c(C4CCCNC4)nc23)c1.Nc1c(Br)c(C2CCCNC2)nc2c(-c3cnn(CCO)c3)cnn12.Nc1c(Br)c(C2CCCNC2)nc2c(-c3cnoc3)cnn12.Nc1cc(C2CCCNC2)nc2c(-c3cnn(Cc4ccncc4)c3)cnn12
InChIInChI=1S/C24H27N7O2.C22H22N8.C20H22N8.C18H24N8O.2C17H16BrN7.C17H23N7O.C17H17N7.C16H20BrN7O.C16H20BrN7.C15H18IN7.C14H15BrN6O/c1-2-33-24(32)22(16-7-4-3-5-8-16)30-15-18(13-27-30)19-14-28-31-21(25)11-20(29-23(19)31)17-9-6-10-26-12-17;23-9-15-4-1-2-5-17(15)13-29-14-18(11-26-29)19-12-27-30-21(24)8-20(28-22(19)30)16-6-3-7-25-10-16;21-19-8-18(15-2-1-5-23-9-15)26-20-17(11-25-28(19)20)16-10-24-27(13-16)12-14-3-6-22-7-4-14;1-24(2)17(27)11-25-10-13(8-21-25)14-9-22-26-16(19)6-15(23-18(14)26)12-4-3-5-20-7-12;18-14-15(11-2-1-5-21-7-11)24-17-13(9-23-25(17)16(14)20)10-3-4-12(6-19)22-8-10;18-14-15(11-2-1-3-21-7-11)24-17-13(9-23-25(17)16(14)20)12-4-10(5-19)6-22-8-12;1-22-10-13(8-19-22)14-9-20-24-16(18)7-15(21-17(14)24)12-3-2-4-23(11-12)5-6-25;18-7-13-4-3-11(9-21-13)14-10-22-24-16(19)6-15(23-17(14)24)12-2-1-5-20-8-12;17-13-14(10-2-1-3-19-6-10)22-16-12(8-21-24(16)15(13)18)11-7-20-23(9-11)4-5-25;1-2-23-9-11(7-20-23)12-8-21-24-15(18)13(17)14(22-16(12)24)10-4-3-5-19-6-10;1-22-8-10(6-19-22)11-7-20-23-14(17)12(16)13(21-15(11)23)9-3-2-4-18-5-9;15-11-12(8-2-1-3-17-4-8)20-14-10(9-5-19-22-7-9)6-18-21(14)13(11)16/h3-5,7-8,11,13-15,17,22,26H,2,6,9-10,12,25H2,1H3;1-2,4-5,8,11-12,14,16,25H,3,6-7,10,13,24H2;3-4,6-8,10-11,13,15,23H,1-2,5,9,12,21H2;6,8-10,12,20H,3-5,7,11,19H2,1-2H3;3-4,8-9,11,21H,1-2,5,7,20H2;4,6,8-9,11,21H,1-3,7,20H2;7-10,12,25H,2-6,11,18H2,1H3;3-4,6,9-10,12,20H,1-2,5,8,19H2;7-10,19,25H,1-6,18H2;7-10,19H,2-6,18H2,1H3;6-9,18H,2-5,17H2,1H3;5-8,17H,1-4,16H2
InChIKeyAWRNLAAJOYKBHQ-UHFFFAOYSA-N
XLogP23.52
TPSA1212.47 Ų
H-Bond Donors25
H-Bond Acceptors91
Rotatable Bonds39
Heavy Atoms311
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004627.28
LogP ≤ 523.52
H-Bond Donors ≤ 525
H-Bond Acceptors ≤ 1091

Analyze 2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine with MolForge

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What is the IUPAC name of 2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine (CID 157254167) is 2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine is CCOC(=O)C(c1ccccc1)n1cc(-c2cnn3c(N)cc(C4CCCNC4)nc23)cn1.CCn1cc(-c2cnn3c(N)c(Br)c(C4CCCNC4)nc23)cn1.CN(C)C(=O)Cn1cc(-c2cnn3c(N)cc(C4CCCNC4)nc23)cn1.Cn1cc(-c2cnn3c(N)c(I)c(C4CCCNC4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4CCCN(CCO)C4)nc23)cn1.N#Cc1ccc(-c2cnn3c(N)c(Br)c(C4CCCNC4)nc23)cn1.N#Cc1ccc(-c2cnn3c(N)cc(C4CCCNC4)nc23)cn1.N#Cc1ccccc1Cn1cc(-c2cnn3c(N)cc(C4CCCNC4)nc23)cn1.N#Cc1cncc(-c2cnn3c(N)c(Br)c(C4CCCNC4)nc23)c1.Nc1c(Br)c(C2CCCNC2)nc2c(-c3cnn(CCO)c3)cnn12.Nc1c(Br)c(C2CCCNC2)nc2c(-c3cnoc3)cnn12.Nc1cc(C2CCCNC2)nc2c(-c3cnn(Cc4ccncc4)c3)cnn12.
What is the InChIKey of 2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is AWRNLAAJOYKBHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N7O2.C22H22N8.C20H22N8.C18H24N8O.2C17H16BrN7.C17H23N7O.C17H17N7.C16H20BrN7O.C16H20BrN7.C15H18IN7.C14H15BrN6O/c1-2-33-24(32)22(16-7-4-3-5-8-16)30-15-18(13-27-30)19-14-28-31-21(25)11-20(29-23(19)31)17-9-6-10-26-12-17;23-9-15-4-1-2-5-17(15)13-29-14-18(11-26-29)19-12-27-30-21(24)8-20(28-22(19)30)16-6-3-7-25-10-16;21-19-8-18(15-2-1-5-23-9-15)26-20-17(11-25-28(19)20)16-10-24-27(13-16)12-14-3-6-22-7-4-14;1-24(2)17(27)11-25-10-13(8-21-25)14-9-22-26-16(19)6-15(23-18(14)26)12-4-3-5-20-7-12;18-14-15(11-2-1-5-21-7-11)24-17-13(9-23-25(17)16(14)20)10-3-4-12(6-19)22-8-10;18-14-15(11-2-1-3-21-7-11)24-17-13(9-23-25(17)16(14)20)12-4-10(5-19)6-22-8-12;1-22-10-13(8-19-22)14-9-20-24-16(18)7-15(21-17(14)24)12-3-2-4-23(11-12)5-6-25;18-7-13-4-3-11(9-21-13)14-10-22-24-16(19)6-15(23-17(14)24)12-2-1-5-20-8-12;17-13-14(10-2-1-3-19-6-10)22-16-12(8-21-24(16)15(13)18)11-7-20-23(9-11)4-5-25;1-2-23-9-11(7-20-23)12-8-21-24-15(18)13(17)14(22-16(12)24)10-4-3-5-19-6-10;1-22-8-10(6-19-22)11-7-20-23-14(17)12(16)13(21-15(11)23)9-3-2-4-18-5-9;15-11-12(8-2-1-3-17-4-8)20-14-10(9-5-19-22-7-9)6-18-21(14)13(11)16/h3-5,7-8,11,13-15,17,22,26H,2,6,9-10,12,25H2,1H3;1-2,4-5,8,11-12,14,16,25H,3,6-7,10,13,24H2;3-4,6-8,10-11,13,15,23H,1-2,5,9,12,21H2;6,8-10,12,20H,3-5,7,11,19H2,1-2H3;3-4,8-9,11,21H,1-2,5,7,20H2;4,6,8-9,11,21H,1-3,7,20H2;7-10,12,25H,2-6,11,18H2,1H3;3-4,6,9-10,12,20H,1-2,5,8,19H2;7-10,19,25H,1-6,18H2;7-10,19H,2-6,18H2,1H3;6-9,18H,2-5,17H2,1H3;5-8,17H,1-4,16H2.
What are the key properties of 2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine?
2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 4627.28 g/mol, XLogP of 23.52, 39 rotatable bonds, 25 hydrogen bond donors, and 91 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]ethanol;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;5-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-3-carbonitrile;2-[3-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanol;2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-N,N-dimethylacetamide;2-[[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]methyl]benzonitrile;5-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyridine-2-carbonitrile;6-bromo-3-(1-ethylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1,2-oxazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 2-[4-(7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)pyrazol-1-yl]-2-phenylacetate;6-iodo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-piperidin-3-yl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 157254167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).