5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one

C15H15NO3 — CID 53446652

IUPAC5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one
SMILESCCn1c(O)c(C(=O)c2ccccc2)c(C)cc1=O
InChIInChI=1S/C15H15NO3/c1-3-16-12(17)9-10(2)13(15(16)19)14(18)11-7-5-4-6-8-11/h4-9,19H,3H2,1-2H3
InChIKeyGPLXXNSHXSVCHS-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.11
Rot. Bonds3

About 5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one

5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one (PubChem CID 53446652) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one.

Molecular Properties

Compound Name5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one
PubChem CID53446652
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one
SMILESCCn1c(O)c(C(=O)c2ccccc2)c(C)cc1=O
InChIInChI=1S/C15H15NO3/c1-3-16-12(17)9-10(2)13(15(16)19)14(18)11-7-5-4-6-8-11/h4-9,19H,3H2,1-2H3
InChIKeyGPLXXNSHXSVCHS-UHFFFAOYSA-N
XLogP2.11
TPSA59.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one?
The IUPAC name of 5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one (CID 53446652) is 5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one.
What is the SMILES notation for 5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one?
The canonical SMILES for 5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one is CCn1c(O)c(C(=O)c2ccccc2)c(C)cc1=O.
What is the InChIKey of 5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one?
The InChIKey is GPLXXNSHXSVCHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c1-3-16-12(17)9-10(2)13(15(16)19)14(18)11-7-5-4-6-8-11/h4-9,19H,3H2,1-2H3.
What are the key properties of 5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one?
5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one has a molecular weight of 257.29 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one is sourced from PubChem (CID 53446652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).