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

C14H18N6 — CID 56904909

IUPAC5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCCc1cc(NCCn2cccn2)n2nccc2n1
InChIInChI=1S/C14H18N6/c1-2-4-12-11-14(20-13(18-12)5-7-17-20)15-8-10-19-9-3-6-16-19/h3,5-7,9,11,15H,2,4,8,10H2,1H3
InChIKeyJKDGRUQDEHQAFL-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.99
Rot. Bonds6

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

5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 56904909) has the molecular formula C14H18N6 and a molecular weight of 270.34 g/mol. Its IUPAC name is 5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID56904909
Molecular FormulaC14H18N6
Molecular Weight270.34 g/mol
Exact Mass270.16
IUPAC Name5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCCc1cc(NCCn2cccn2)n2nccc2n1
InChIInChI=1S/C14H18N6/c1-2-4-12-11-14(20-13(18-12)5-7-17-20)15-8-10-19-9-3-6-16-19/h3,5-7,9,11,15H,2,4,8,10H2,1H3
InChIKeyJKDGRUQDEHQAFL-UHFFFAOYSA-N
XLogP1.99
TPSA60.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 56904909) is 5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine is CCCc1cc(NCCn2cccn2)n2nccc2n1.
What is the InChIKey of 5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is JKDGRUQDEHQAFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6/c1-2-4-12-11-14(20-13(18-12)5-7-17-20)15-8-10-19-9-3-6-16-19/h3,5-7,9,11,15H,2,4,8,10H2,1H3.
What are the key properties of 5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 270.34 g/mol, XLogP of 1.99, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-N-(2-pyrazol-1-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 56904909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).