6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine

C89H111BrFN43OS — CID 159134734

IUPAC6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCn1cc(-c2cnn3c(N)c(Br)c(C4CCCCN4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4(C)CCCNC4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4(F)CCCNC4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4CCCCN4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4CNCCN4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4CNCCS4=O)nc23)cn1
InChIInChI=1S/C16H21N7.C15H18BrN7.C15H18FN7.C15H19N7.C14H18N8.C14H17N7OS/c1-16(4-3-5-18-10-16)13-6-14(17)23-15(21-13)12(8-20-23)11-7-19-22(2)9-11;1-22-8-9(6-19-22)10-7-20-23-14(17)12(16)13(21-15(10)23)11-4-2-3-5-18-11;1-22-8-10(6-19-22)11-7-20-23-13(17)5-12(21-14(11)23)15(16)3-2-4-18-9-15;1-21-9-10(7-18-21)11-8-19-22-14(16)6-13(20-15(11)22)12-4-2-3-5-17-12;1-21-8-9(5-18-21)10-6-19-22-13(15)4-11(20-14(10)22)12-7-16-2-3-17-12;1-20-8-9(5-17-20)10-6-18-21-13(15)4-11(19-14(10)21)12-7-16-2-3-23(12)22/h6-9,18H,3-5,10,17H2,1-2H3;6-8,11,18H,2-5,17H2,1H3;5-8,18H,2-4,9,17H2,1H3;6-9,12,17H,2-5,16H2,1H3;4-6,8,12,16-17H,2-3,7,15H2,1H3;4-6,8,12,16H,2-3,7,15H2,1H3
InChIKeyKHINVNDMHAOFME-UHFFFAOYSA-N
MW1930.14 g/mol
LogP6.48
Rot. Bonds12

About 6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine

6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 159134734) has the molecular formula C89H111BrFN43OS and a molecular weight of 1930.14 g/mol. Its IUPAC name is 6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID159134734
Molecular FormulaC89H111BrFN43OS
Molecular Weight1930.14 g/mol
Exact Mass1927.88
IUPAC Name6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCn1cc(-c2cnn3c(N)c(Br)c(C4CCCCN4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4(C)CCCNC4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4(F)CCCNC4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4CCCCN4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4CNCCN4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4CNCCS4=O)nc23)cn1
InChIInChI=1S/C16H21N7.C15H18BrN7.C15H18FN7.C15H19N7.C14H18N8.C14H17N7OS/c1-16(4-3-5-18-10-16)13-6-14(17)23-15(21-13)12(8-20-23)11-7-19-22(2)9-11;1-22-8-9(6-19-22)10-7-20-23-14(17)12(16)13(21-15(10)23)11-4-2-3-5-18-11;1-22-8-10(6-19-22)11-7-20-23-13(17)5-12(21-14(11)23)15(16)3-2-4-18-9-15;1-21-9-10(7-18-21)11-8-19-22-14(16)6-13(20-15(11)22)12-4-2-3-5-17-12;1-21-8-9(5-18-21)10-6-19-22-13(15)4-11(20-14(10)22)12-7-16-2-3-17-12;1-20-8-9(5-17-20)10-6-18-21-13(15)4-11(19-14(10)21)12-7-16-2-3-23(12)22/h6-9,18H,3-5,10,17H2,1-2H3;6-8,11,18H,2-5,17H2,1H3;5-8,18H,2-4,9,17H2,1H3;6-9,12,17H,2-5,16H2,1H3;4-6,8,12,16-17H,2-3,7,15H2,1H3;4-6,8,12,16H,2-3,7,15H2,1H3
InChIKeyKHINVNDMHAOFME-UHFFFAOYSA-N
XLogP6.48
TPSA545.46 Ų
H-Bond Donors13
H-Bond Acceptors44
Rotatable Bonds12
Heavy Atoms136
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001930.14
LogP ≤ 56.48
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1044

Analyze 6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine with MolForge

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Launch Full Analysis

Related Compounds

N-[4-[7-amino-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]pyrazol-1-yl]-6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 71011341
5-(5-amino-1-iodopentyl)-N-[4-[7-amino-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]pyrazol-1-yl]-6-bromo-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 89718042
5-[6-[4-(7-Amino-6-bromo-5-thiomorpholin-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)-1-methylpyrazol-3-yl]piperidin-3-yl]-6-chloro-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 143440071
6-Bromo-3-(1-methylpyrazol-4-yl)-5-thiomorpholin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-chloro-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 143440171
6-bromo-3-(5-methylcyclopenta-1,4-dien-1-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(2-methylthiophen-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-5-piperidin-3-yl-3-(3H-pyrrol-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(4-methylcyclopenta-1,4-dien-1-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;bis(5-piperidin-3-yl-3-prop-1-ynylpyrazolo[1,5-a]pyrimidin-7-amine)
CID 157455036
5-(4-Aminobutyl)-6-bromo-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(4-aminobutyl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(2-aminoethyl)-6-bromo-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-aminopropyl)-6-bromo-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(1-fluorocyclohexyl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(1-methylcyclohexyl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 157558911
6-Bromo-7-methyl-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidine;6-bromo-7-methyl-3-(1-methylpyrazol-4-yl)-5-(1-propan-2-ylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidine;6-bromo-7-(2-methylpropyl)-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidine
CID 157600010
5-[(1S,3R)-3-aminocyclohexyl]-6-bromo-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-[(1S,3R)-3-aminocyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-[(1R,3R)-3-aminocyclopentyl]-6-bromo-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-[(1R,3S)-3-aminocyclopentyl]-6-bromo-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-[(1R,3S)-3-aminocyclopentyl]-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-[(1R,3R)-3-aminocyclopentyl]-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 158115193
(2S,5S)-5-[7-amino-6-bromo-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-2-carboxamide;bis((2S,5S)-5-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-methylpiperidine-2-carboxamide)
CID 158124549
N-tert-butyl-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;N-(cyclopentylmethyl)-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;N-cyclopentyl-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-N-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 158288752
5-(4-Aminobutyl)-6-bromo-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(4-aminobutyl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 158413475
5-(2-Aminopropyl)-6-bromo-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-aminopropyl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1-methylpyrazol-4-yl)-5-(piperidin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1-methylpyrazol-4-yl)-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1-methylpyrazol-4-yl)-5-(pyrrolidin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(piperidin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(pyrrolidin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 158604424

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine (CID 159134734) is 6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine is Cn1cc(-c2cnn3c(N)c(Br)c(C4CCCCN4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4(C)CCCNC4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4(F)CCCNC4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4CCCCN4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4CNCCN4)nc23)cn1.Cn1cc(-c2cnn3c(N)cc(C4CNCCS4=O)nc23)cn1.
What is the InChIKey of 6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is KHINVNDMHAOFME-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N7.C15H18BrN7.C15H18FN7.C15H19N7.C14H18N8.C14H17N7OS/c1-16(4-3-5-18-10-16)13-6-14(17)23-15(21-13)12(8-20-23)11-7-19-22(2)9-11;1-22-8-9(6-19-22)10-7-20-23-14(17)12(16)13(21-15(10)23)11-4-2-3-5-18-11;1-22-8-10(6-19-22)11-7-20-23-13(17)5-12(21-14(11)23)15(16)3-2-4-18-9-15;1-21-9-10(7-18-21)11-8-19-22-14(16)6-13(20-15(11)22)12-4-2-3-5-17-12;1-21-8-9(5-18-21)10-6-19-22-13(15)4-11(20-14(10)22)12-7-16-2-3-17-12;1-20-8-9(5-17-20)10-6-18-21-13(15)4-11(19-14(10)21)12-7-16-2-3-23(12)22/h6-9,18H,3-5,10,17H2,1-2H3;6-8,11,18H,2-5,17H2,1H3;5-8,18H,2-4,9,17H2,1H3;6-9,12,17H,2-5,16H2,1H3;4-6,8,12,16-17H,2-3,7,15H2,1H3;4-6,8,12,16H,2-3,7,15H2,1H3.
What are the key properties of 6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?
6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 1930.14 g/mol, XLogP of 6.48, 12 rotatable bonds, 13 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(3-fluoropiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(3-methylpiperidin-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-(1-oxo-1,4-thiazinan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 159134734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).