1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one

C8H11N3O — CID 173471230

IUPAC1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one
SMILESO=C1CCCN1C1=NC=CNC1
InChIInChI=1S/C8H11N3O/c12-8-2-1-5-11(8)7-6-9-3-4-10-7/h3-4,9H,1-2,5-6H2
InChIKeyCKMZTHDRPBOLEE-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.08
Rot. Bonds

About 1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one

1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one (PubChem CID 173471230) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one
PubChem CID173471230
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one
SMILESO=C1CCCN1C1=NC=CNC1
InChIInChI=1S/C8H11N3O/c12-8-2-1-5-11(8)7-6-9-3-4-10-7/h3-4,9H,1-2,5-6H2
InChIKeyCKMZTHDRPBOLEE-UHFFFAOYSA-N
XLogP0.08
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(1,2-dihydropyrazin-3-yl)pyrrolidin-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-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one?
The IUPAC name of 1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one (CID 173471230) is 1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one.
What is the SMILES notation for 1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one?
The canonical SMILES for 1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one is O=C1CCCN1C1=NC=CNC1.
What is the InChIKey of 1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one?
The InChIKey is CKMZTHDRPBOLEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c12-8-2-1-5-11(8)7-6-9-3-4-10-7/h3-4,9H,1-2,5-6H2.
What are the key properties of 1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one?
1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one has a molecular weight of 165.20 g/mol, XLogP of 0.08, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-dihydropyrazin-3-yl)pyrrolidin-2-one is sourced from PubChem (CID 173471230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).