3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one

C9H12N4O2 — CID 103703308

IUPAC3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one
SMILESCN1CCC(Nc2ncc[nH]c2=O)C1=O
InChIInChI=1S/C9H12N4O2/c1-13-5-2-6(9(13)15)12-7-8(14)11-4-3-10-7/h3-4,6H,2,5H2,1H3,(H,10,12)(H,11,14)
InChIKeySKEVTWOJXABTOV-UHFFFAOYSA-N
MW208.22 g/mol
LogP-0.59
Rot. Bonds2

About 3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one

3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one (PubChem CID 103703308) has the molecular formula C9H12N4O2 and a molecular weight of 208.22 g/mol. Its IUPAC name is 3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one.

Molecular Properties

Compound Name3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one
PubChem CID103703308
Molecular FormulaC9H12N4O2
Molecular Weight208.22 g/mol
Exact Mass208.10
IUPAC Name3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one
SMILESCN1CCC(Nc2ncc[nH]c2=O)C1=O
InChIInChI=1S/C9H12N4O2/c1-13-5-2-6(9(13)15)12-7-8(14)11-4-3-10-7/h3-4,6H,2,5H2,1H3,(H,10,12)(H,11,14)
InChIKeySKEVTWOJXABTOV-UHFFFAOYSA-N
XLogP-0.59
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-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

Related Compounds

3-(3-Aminopyrrolidin-1-yl)-1,2-dihydropyrazin-2-one dihydrochloride
CID 132343858
(3R)-1-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpyrrolidine-3-carboxamide
CID 177661959
3-(3-aminopyrrolidin-1-yl)pyrazin-2(1H)-one
CID 114570919
1-(2-Oxopentan-3-yl)-3-(4-oxopentylamino)pyrazin-2-one
CID 22969712
1-Methyl-3-[3-(2-oxopyrrolidin-1-yl)propylamino]pyrazin-2-one
CID 22969726
1-[(3S)-2-oxopentan-3-yl]-3-[3-(2-oxopyrrolidin-1-yl)propylamino]pyrazin-2-one
CID 59125798
(2S)-2-[2-oxo-3-[3-(2-oxopyrrolidin-1-yl)propylamino]pyrazin-1-yl]butanoic acid
CID 59909437
[3-imino-1-[[3-oxo-4-[(2S)-1-oxo-1-[(2-oxo-3-pyrrolidin-1-ylpropyl)amino]butan-2-yl]pyrazin-2-yl]amino]butan-2-ylidene]azanide
CID 142038972
5-Bromo-1-methyl-3-[3-(2-oxopyrrolidin-1-yl)propylamino]pyrazin-2-one
CID 155662568
1-(1,2-Dihydropyrazin-3-yl)pyrrolidin-2-one
CID 173471230
N-butan-2-yl-3-[(4-methyl-3-oxopyrazin-2-yl)amino]propanamide
CID 55130604
1-Methyl-3-[(1-propan-2-ylpyrrolidin-3-yl)methylamino]pyrazin-2-one
CID 55130790

Frequently Asked Questions

What is the IUPAC name of 3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one?
The IUPAC name of 3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one (CID 103703308) is 3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one.
What is the SMILES notation for 3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one?
The canonical SMILES for 3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one is CN1CCC(Nc2ncc[nH]c2=O)C1=O.
What is the InChIKey of 3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one?
The InChIKey is SKEVTWOJXABTOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O2/c1-13-5-2-6(9(13)15)12-7-8(14)11-4-3-10-7/h3-4,6H,2,5H2,1H3,(H,10,12)(H,11,14).
What are the key properties of 3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one?
3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one has a molecular weight of 208.22 g/mol, XLogP of -0.59, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]-1H-pyrazin-2-one is sourced from PubChem (CID 103703308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).