5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one

C15H15NO3 — CID 74983124

IUPAC5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one
SMILESCC(C)n1cc(C(=O)c2ccccc2O)ccc1=O
InChIInChI=1S/C15H15NO3/c1-10(2)16-9-11(7-8-14(16)18)15(19)12-5-3-4-6-13(12)17/h3-10,17H,1-2H3
InChIKeyGVWUICWEYABUCF-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.37
Rot. Bonds3

About 5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one

5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one (PubChem CID 74983124) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one.

Molecular Properties

Compound Name5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one
PubChem CID74983124
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one
SMILESCC(C)n1cc(C(=O)c2ccccc2O)ccc1=O
InChIInChI=1S/C15H15NO3/c1-10(2)16-9-11(7-8-14(16)18)15(19)12-5-3-4-6-13(12)17/h3-10,17H,1-2H3
InChIKeyGVWUICWEYABUCF-UHFFFAOYSA-N
XLogP2.37
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 ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one?
The IUPAC name of 5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one (CID 74983124) is 5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one.
What is the SMILES notation for 5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one?
The canonical SMILES for 5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one is CC(C)n1cc(C(=O)c2ccccc2O)ccc1=O.
What is the InChIKey of 5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one?
The InChIKey is GVWUICWEYABUCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c1-10(2)16-9-11(7-8-14(16)18)15(19)12-5-3-4-6-13(12)17/h3-10,17H,1-2H3.
What are the key properties of 5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one?
5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one has a molecular weight of 257.29 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-hydroxybenzoyl)-1-propan-2-ylpyridin-2-one is sourced from PubChem (CID 74983124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).