1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one

C10H11N3O — CID 23318761

IUPAC1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one
SMILESCn1cc(N2C=CNC=C2)ccc1=O
InChIInChI=1S/C10H11N3O/c1-12-8-9(2-3-10(12)14)13-6-4-11-5-7-13/h2-8,11H,1H3
InChIKeyNGYOFWLEBCWPRC-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.74
Rot. Bonds1

About 1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one

1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one (PubChem CID 23318761) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one.

Molecular Properties

Compound Name1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one
PubChem CID23318761
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one
SMILESCn1cc(N2C=CNC=C2)ccc1=O
InChIInChI=1S/C10H11N3O/c1-12-8-9(2-3-10(12)14)13-6-4-11-5-7-13/h2-8,11H,1H3
InChIKeyNGYOFWLEBCWPRC-UHFFFAOYSA-N
XLogP0.74
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one?
The IUPAC name of 1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one (CID 23318761) is 1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one.
What is the SMILES notation for 1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one?
The canonical SMILES for 1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one is Cn1cc(N2C=CNC=C2)ccc1=O.
What is the InChIKey of 1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one?
The InChIKey is NGYOFWLEBCWPRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-12-8-9(2-3-10(12)14)13-6-4-11-5-7-13/h2-8,11H,1H3.
What are the key properties of 1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one?
1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one has a molecular weight of 189.22 g/mol, XLogP of 0.74, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-(1H-pyrazin-4-yl)pyridin-2-one is sourced from PubChem (CID 23318761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).