1-(2-pyridin-2-ylethyl)pyridin-2-one

C12H12N2O — CID 116618481

IUPAC1-(2-pyridin-2-ylethyl)pyridin-2-one
SMILESO=c1ccccn1CCc1ccccn1
InChIInChI=1S/C12H12N2O/c15-12-6-2-4-9-14(12)10-7-11-5-1-3-8-13-11/h1-6,8-9H,7,10H2
InChIKeyOQJDKSXXTNCORP-UHFFFAOYSA-N
MW200.24 g/mol
LogP1.49
Rot. Bonds3

About 1-(2-pyridin-2-ylethyl)pyridin-2-one

1-(2-pyridin-2-ylethyl)pyridin-2-one (PubChem CID 116618481) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 1-(2-pyridin-2-ylethyl)pyridin-2-one.

Molecular Properties

Compound Name1-(2-pyridin-2-ylethyl)pyridin-2-one
PubChem CID116618481
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name1-(2-pyridin-2-ylethyl)pyridin-2-one
SMILESO=c1ccccn1CCc1ccccn1
InChIInChI=1S/C12H12N2O/c15-12-6-2-4-9-14(12)10-7-11-5-1-3-8-13-11/h1-6,8-9H,7,10H2
InChIKeyOQJDKSXXTNCORP-UHFFFAOYSA-N
XLogP1.49
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-pyridin-2-ylethyl)pyridin-2-one?
The IUPAC name of 1-(2-pyridin-2-ylethyl)pyridin-2-one (CID 116618481) is 1-(2-pyridin-2-ylethyl)pyridin-2-one.
What is the SMILES notation for 1-(2-pyridin-2-ylethyl)pyridin-2-one?
The canonical SMILES for 1-(2-pyridin-2-ylethyl)pyridin-2-one is O=c1ccccn1CCc1ccccn1.
What is the InChIKey of 1-(2-pyridin-2-ylethyl)pyridin-2-one?
The InChIKey is OQJDKSXXTNCORP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c15-12-6-2-4-9-14(12)10-7-11-5-1-3-8-13-11/h1-6,8-9H,7,10H2.
What are the key properties of 1-(2-pyridin-2-ylethyl)pyridin-2-one?
1-(2-pyridin-2-ylethyl)pyridin-2-one has a molecular weight of 200.24 g/mol, XLogP of 1.49, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-pyridin-2-ylethyl)pyridin-2-one is sourced from PubChem (CID 116618481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).