6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine

C13H12N8 — CID 169140873

IUPAC6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine
SMILESCn1cc(-c2cn3nccc3c(Nc3ccn[nH]3)n2)cn1
InChIInChI=1S/C13H12N8/c1-20-7-9(6-16-20)10-8-21-11(2-5-15-21)13(17-10)18-12-3-4-14-19-12/h2-8H,1H3,(H2,14,17,18,19)
InChIKeyKGYZCSJLCJGOSE-UHFFFAOYSA-N
MW280.30 g/mol
LogP1.60
Rot. Bonds3

About 6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine

6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 169140873) has the molecular formula C13H12N8 and a molecular weight of 280.30 g/mol. Its IUPAC name is 6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound Name6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine
PubChem CID169140873
Molecular FormulaC13H12N8
Molecular Weight280.30 g/mol
Exact Mass280.12
IUPAC Name6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine
SMILESCn1cc(-c2cn3nccc3c(Nc3ccn[nH]3)n2)cn1
InChIInChI=1S/C13H12N8/c1-20-7-9(6-16-20)10-8-21-11(2-5-15-21)13(17-10)18-12-3-4-14-19-12/h2-8H,1H3,(H2,14,17,18,19)
InChIKeyKGYZCSJLCJGOSE-UHFFFAOYSA-N
XLogP1.60
TPSA88.72 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of 6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine (CID 169140873) is 6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for 6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for 6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine is Cn1cc(-c2cn3nccc3c(Nc3ccn[nH]3)n2)cn1.
What is the InChIKey of 6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is KGYZCSJLCJGOSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N8/c1-20-7-9(6-16-20)10-8-21-11(2-5-15-21)13(17-10)18-12-3-4-14-19-12/h2-8H,1H3,(H2,14,17,18,19).
What are the key properties of 6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine?
6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 280.30 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 169140873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).