N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine

C14H18N6 — CID 70744947

IUPACN,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(N(C)CCn2cccn2)n2nc(C)cc2n1
InChIInChI=1S/C14H18N6/c1-11-10-14(20-13(16-11)9-12(2)17-20)18(3)7-8-19-6-4-5-15-19/h4-6,9-10H,7-8H2,1-3H3
InChIKeyKBTCXJGGTWDISA-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.68
Rot. Bonds4

About N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine

N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 70744947) has the molecular formula C14H18N6 and a molecular weight of 270.34 g/mol. Its IUPAC name is N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound NameN,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID70744947
Molecular FormulaC14H18N6
Molecular Weight270.34 g/mol
Exact Mass270.16
IUPAC NameN,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(N(C)CCn2cccn2)n2nc(C)cc2n1
InChIInChI=1S/C14H18N6/c1-11-10-14(20-13(16-11)9-12(2)17-20)18(3)7-8-19-6-4-5-15-19/h4-6,9-10H,7-8H2,1-3H3
InChIKeyKBTCXJGGTWDISA-UHFFFAOYSA-N
XLogP1.68
TPSA51.25 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

Trapidil
CID 5531
Pyrazolo(1,5-a)pyrimidine, 5,7-dimethyl-
CID 215186
5-Methylpyrazolo[1,5-a]pyrimidine
CID 12581392
5-Methyl-s-triazolo(1,5-a)pyrimidine
CID 584230
5,7-Dimethyl-2-(2-(6-(pyrrolidin-1-yl)pyrazin-2-yl)ethyl)-[1,2,4]triazolo-[1,5-a]pyrimidine
CID 72706927
2,3-dimethyl-5-(2-(1-methyl-3-(pyrrolidin-1-yl)-1H-1,2,4-triazol-5-yl)ethyl)pyrazolo[1,5-a]pyrimidine
CID 75201365
6-(3,5-dimethyl-1H-pyrazol-1-yl)[1,2,4]triazolo[4,3-b]pyridazine
CID 702232
2-Methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 1480446
5,8-dimethyl-2-[(E)-2-[2-methyl-5-(1H-pyrazol-5-yl)-1,2,4-triazol-3-yl]ethenyl]-[1,2,4]triazolo[1,5-a]pyrazine
CID 165415127
5-Methyl-2-[2-(2-methyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-c]pyrimidine
CID 165415181
5,8-Dimethyl-2-[2-(2-methyl-5-pyrazol-1-yl-1,2,4-triazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyrazine
CID 165415248
7-Methylpyrazolo(1,5-a)pyrimidine
CID 12581393

Frequently Asked Questions

What is the IUPAC name of N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 70744947) is N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine is Cc1cc(N(C)CCn2cccn2)n2nc(C)cc2n1.
What is the InChIKey of N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is KBTCXJGGTWDISA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6/c1-11-10-14(20-13(16-11)9-12(2)17-20)18(3)7-8-19-6-4-5-15-19/h4-6,9-10H,7-8H2,1-3H3.
What are the key properties of N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 270.34 g/mol, XLogP of 1.68, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,5-trimethyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 70744947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).