1-(2-cyclopropylethyl)-3-methylpyrazin-2-one

C10H14N2O — CID 130571194

IUPAC1-(2-cyclopropylethyl)-3-methylpyrazin-2-one
SMILESCc1nccn(CCC2CC2)c1=O
InChIInChI=1S/C10H14N2O/c1-8-10(13)12(7-5-11-8)6-4-9-2-3-9/h5,7,9H,2-4,6H2,1H3
InChIKeyPXTPUYKDHUYHPI-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.35
Rot. Bonds3

About 1-(2-cyclopropylethyl)-3-methylpyrazin-2-one

1-(2-cyclopropylethyl)-3-methylpyrazin-2-one (PubChem CID 130571194) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is 1-(2-cyclopropylethyl)-3-methylpyrazin-2-one.

Molecular Properties

Compound Name1-(2-cyclopropylethyl)-3-methylpyrazin-2-one
PubChem CID130571194
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name1-(2-cyclopropylethyl)-3-methylpyrazin-2-one
SMILESCc1nccn(CCC2CC2)c1=O
InChIInChI=1S/C10H14N2O/c1-8-10(13)12(7-5-11-8)6-4-9-2-3-9/h5,7,9H,2-4,6H2,1H3
InChIKeyPXTPUYKDHUYHPI-UHFFFAOYSA-N
XLogP1.35
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(2-cyclopropylethyl)-3-methylpyrazin-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

2-Oxo-1-methyl-3-isopropylpyrazine
CID 529437
1-methyl-3-isobutyl-2(1H)-pyrazinone
CID 6428853
1,3-Di(propan-2-yl)pyrazin-2-one
CID 20641754
1-Ethyl-3-propan-2-ylpyrazin-2-one
CID 123713354
1-(3-Cyclopropyl-2-methylidenepyrazin-1-yl)ethanone
CID 153585450
1-Ethyl-3-(2-methylpropyl)pyrazin-2-one
CID 165138880
1-(2-Amino-2-cyclopropylethyl)-3-methylpyrazin-2-one
CID 130571112
1-(2-Cyclopropyl-2-oxoethyl)-3-methylpyrazin-2-one
CID 130571142
3-Methyl-1-(2-methylpropyl)pyrazin-2-one
CID 130571191
1-(Cyclobutylmethyl)-3-methylpyrazin-2-one
CID 130571206
3-Isobutyl-1-methyl-d3-2-pyrazinone
CID 131708586

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopropylethyl)-3-methylpyrazin-2-one?
The IUPAC name of 1-(2-cyclopropylethyl)-3-methylpyrazin-2-one (CID 130571194) is 1-(2-cyclopropylethyl)-3-methylpyrazin-2-one.
What is the SMILES notation for 1-(2-cyclopropylethyl)-3-methylpyrazin-2-one?
The canonical SMILES for 1-(2-cyclopropylethyl)-3-methylpyrazin-2-one is Cc1nccn(CCC2CC2)c1=O.
What is the InChIKey of 1-(2-cyclopropylethyl)-3-methylpyrazin-2-one?
The InChIKey is PXTPUYKDHUYHPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-8-10(13)12(7-5-11-8)6-4-9-2-3-9/h5,7,9H,2-4,6H2,1H3.
What are the key properties of 1-(2-cyclopropylethyl)-3-methylpyrazin-2-one?
1-(2-cyclopropylethyl)-3-methylpyrazin-2-one has a molecular weight of 178.24 g/mol, XLogP of 1.35, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopropylethyl)-3-methylpyrazin-2-one is sourced from PubChem (CID 130571194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).