2-(1-methylpyrazol-4-yl)pyrazine

C8H8N4 — CID 4061022

IUPAC2-(1-methylpyrazol-4-yl)pyrazine
SMILESCn1cc(-c2cnccn2)cn1
InChIInChI=1S/C8H8N4/c1-12-6-7(4-11-12)8-5-9-2-3-10-8/h2-6H,1H3
InChIKeyYDQQZEFPMVFBBX-UHFFFAOYSA-N
MW160.18 g/mol
LogP0.88
Rot. Bonds1

About 2-(1-methylpyrazol-4-yl)pyrazine

2-(1-methylpyrazol-4-yl)pyrazine (PubChem CID 4061022) has the molecular formula C8H8N4 and a molecular weight of 160.18 g/mol. Its IUPAC name is 2-(1-methylpyrazol-4-yl)pyrazine.

Molecular Properties

Compound Name2-(1-methylpyrazol-4-yl)pyrazine
PubChem CID4061022
Molecular FormulaC8H8N4
Molecular Weight160.18 g/mol
Exact Mass160.07
IUPAC Name2-(1-methylpyrazol-4-yl)pyrazine
SMILESCn1cc(-c2cnccn2)cn1
InChIInChI=1S/C8H8N4/c1-12-6-7(4-11-12)8-5-9-2-3-10-8/h2-6H,1H3
InChIKeyYDQQZEFPMVFBBX-UHFFFAOYSA-N
XLogP0.88
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.18
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(1-methylpyrazol-4-yl)pyrazine 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 2-(1-methylpyrazol-4-yl)pyrazine?
The IUPAC name of 2-(1-methylpyrazol-4-yl)pyrazine (CID 4061022) is 2-(1-methylpyrazol-4-yl)pyrazine.
What is the SMILES notation for 2-(1-methylpyrazol-4-yl)pyrazine?
The canonical SMILES for 2-(1-methylpyrazol-4-yl)pyrazine is Cn1cc(-c2cnccn2)cn1.
What is the InChIKey of 2-(1-methylpyrazol-4-yl)pyrazine?
The InChIKey is YDQQZEFPMVFBBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4/c1-12-6-7(4-11-12)8-5-9-2-3-10-8/h2-6H,1H3.
What are the key properties of 2-(1-methylpyrazol-4-yl)pyrazine?
2-(1-methylpyrazol-4-yl)pyrazine has a molecular weight of 160.18 g/mol, XLogP of 0.88, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrazol-4-yl)pyrazine is sourced from PubChem (CID 4061022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).