1-pyrazol-1-ylpyrazin-2-one

C7H6N4O — CID 68865480

IUPAC1-pyrazol-1-ylpyrazin-2-one
SMILESO=c1cnccn1-n1cccn1
InChIInChI=1S/C7H6N4O/c12-7-6-8-3-5-10(7)11-4-1-2-9-11/h1-6H
InChIKeyRHEHQXHTVQAIQP-UHFFFAOYSA-N
MW162.15 g/mol
LogP-0.25
Rot. Bonds1

About 1-pyrazol-1-ylpyrazin-2-one

1-pyrazol-1-ylpyrazin-2-one (PubChem CID 68865480) has the molecular formula C7H6N4O and a molecular weight of 162.15 g/mol. Its IUPAC name is 1-pyrazol-1-ylpyrazin-2-one.

Molecular Properties

Compound Name1-pyrazol-1-ylpyrazin-2-one
PubChem CID68865480
Molecular FormulaC7H6N4O
Molecular Weight162.15 g/mol
Exact Mass162.05
IUPAC Name1-pyrazol-1-ylpyrazin-2-one
SMILESO=c1cnccn1-n1cccn1
InChIInChI=1S/C7H6N4O/c12-7-6-8-3-5-10(7)11-4-1-2-9-11/h1-6H
InChIKeyRHEHQXHTVQAIQP-UHFFFAOYSA-N
XLogP-0.25
TPSA52.71 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.15
LogP ≤ 5-0.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-pyrazol-1-ylpyrazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-pyrazol-1-ylpyrazin-2-one?
The IUPAC name of 1-pyrazol-1-ylpyrazin-2-one (CID 68865480) is 1-pyrazol-1-ylpyrazin-2-one.
What is the SMILES notation for 1-pyrazol-1-ylpyrazin-2-one?
The canonical SMILES for 1-pyrazol-1-ylpyrazin-2-one is O=c1cnccn1-n1cccn1.
What is the InChIKey of 1-pyrazol-1-ylpyrazin-2-one?
The InChIKey is RHEHQXHTVQAIQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N4O/c12-7-6-8-3-5-10(7)11-4-1-2-9-11/h1-6H.
What are the key properties of 1-pyrazol-1-ylpyrazin-2-one?
1-pyrazol-1-ylpyrazin-2-one has a molecular weight of 162.15 g/mol, XLogP of -0.25, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrazol-1-ylpyrazin-2-one is sourced from PubChem (CID 68865480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).