1,3-diethyl-6-methylpyridin-2-one

C10H15NO — CID 59678204

IUPAC1,3-diethyl-6-methylpyridin-2-one
SMILESCCc1ccc(C)n(CC)c1=O
InChIInChI=1S/C10H15NO/c1-4-9-7-6-8(3)11(5-2)10(9)12/h6-7H,4-5H2,1-3H3
InChIKeyRAOFEWKWPWEQSF-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.74
Rot. Bonds2

About 1,3-diethyl-6-methylpyridin-2-one

1,3-diethyl-6-methylpyridin-2-one (PubChem CID 59678204) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 1,3-diethyl-6-methylpyridin-2-one.

Molecular Properties

Compound Name1,3-diethyl-6-methylpyridin-2-one
PubChem CID59678204
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name1,3-diethyl-6-methylpyridin-2-one
SMILESCCc1ccc(C)n(CC)c1=O
InChIInChI=1S/C10H15NO/c1-4-9-7-6-8(3)11(5-2)10(9)12/h6-7H,4-5H2,1-3H3
InChIKeyRAOFEWKWPWEQSF-UHFFFAOYSA-N
XLogP1.74
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3-diethyl-6-methylpyridin-2-one?
The IUPAC name of 1,3-diethyl-6-methylpyridin-2-one (CID 59678204) is 1,3-diethyl-6-methylpyridin-2-one.
What is the SMILES notation for 1,3-diethyl-6-methylpyridin-2-one?
The canonical SMILES for 1,3-diethyl-6-methylpyridin-2-one is CCc1ccc(C)n(CC)c1=O.
What is the InChIKey of 1,3-diethyl-6-methylpyridin-2-one?
The InChIKey is RAOFEWKWPWEQSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-4-9-7-6-8(3)11(5-2)10(9)12/h6-7H,4-5H2,1-3H3.
What are the key properties of 1,3-diethyl-6-methylpyridin-2-one?
1,3-diethyl-6-methylpyridin-2-one has a molecular weight of 165.24 g/mol, XLogP of 1.74, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diethyl-6-methylpyridin-2-one is sourced from PubChem (CID 59678204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).