1-ethyl-6-(2-ethylphenyl)pyridin-2-one

C15H17NO — CID 159464273

IUPAC1-ethyl-6-(2-ethylphenyl)pyridin-2-one
SMILESCCc1ccccc1-c1cccc(=O)n1CC
InChIInChI=1S/C15H17NO/c1-3-12-8-5-6-9-13(12)14-10-7-11-15(17)16(14)4-2/h5-11H,3-4H2,1-2H3
InChIKeyJIXOCXJHEOFWTA-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.10
Rot. Bonds3

About 1-ethyl-6-(2-ethylphenyl)pyridin-2-one

1-ethyl-6-(2-ethylphenyl)pyridin-2-one (PubChem CID 159464273) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 1-ethyl-6-(2-ethylphenyl)pyridin-2-one.

Molecular Properties

Compound Name1-ethyl-6-(2-ethylphenyl)pyridin-2-one
PubChem CID159464273
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name1-ethyl-6-(2-ethylphenyl)pyridin-2-one
SMILESCCc1ccccc1-c1cccc(=O)n1CC
InChIInChI=1S/C15H17NO/c1-3-12-8-5-6-9-13(12)14-10-7-11-15(17)16(14)4-2/h5-11H,3-4H2,1-2H3
InChIKeyJIXOCXJHEOFWTA-UHFFFAOYSA-N
XLogP3.10
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-(2-ethylphenyl)pyridin-2-one?
The IUPAC name of 1-ethyl-6-(2-ethylphenyl)pyridin-2-one (CID 159464273) is 1-ethyl-6-(2-ethylphenyl)pyridin-2-one.
What is the SMILES notation for 1-ethyl-6-(2-ethylphenyl)pyridin-2-one?
The canonical SMILES for 1-ethyl-6-(2-ethylphenyl)pyridin-2-one is CCc1ccccc1-c1cccc(=O)n1CC.
What is the InChIKey of 1-ethyl-6-(2-ethylphenyl)pyridin-2-one?
The InChIKey is JIXOCXJHEOFWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-3-12-8-5-6-9-13(12)14-10-7-11-15(17)16(14)4-2/h5-11H,3-4H2,1-2H3.
What are the key properties of 1-ethyl-6-(2-ethylphenyl)pyridin-2-one?
1-ethyl-6-(2-ethylphenyl)pyridin-2-one has a molecular weight of 227.31 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-(2-ethylphenyl)pyridin-2-one is sourced from PubChem (CID 159464273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).