4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one

C14H15NO2 — CID 54694339

IUPAC4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one
SMILESCc1cc(O)cc(=O)n1CCc1ccccc1
InChIInChI=1S/C14H15NO2/c1-11-9-13(16)10-14(17)15(11)8-7-12-5-3-2-4-6-12/h2-6,9-10,16H,7-8H2,1H3
InChIKeyCQJWDBBIQCWNAE-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.11
Rot. Bonds3

About 4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one

4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one (PubChem CID 54694339) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one
PubChem CID54694339
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one
SMILESCc1cc(O)cc(=O)n1CCc1ccccc1
InChIInChI=1S/C14H15NO2/c1-11-9-13(16)10-14(17)15(11)8-7-12-5-3-2-4-6-12/h2-6,9-10,16H,7-8H2,1H3
InChIKeyCQJWDBBIQCWNAE-UHFFFAOYSA-N
XLogP2.11
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one?
The IUPAC name of 4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one (CID 54694339) is 4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one.
What is the SMILES notation for 4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one?
The canonical SMILES for 4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one is Cc1cc(O)cc(=O)n1CCc1ccccc1.
What is the InChIKey of 4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one?
The InChIKey is CQJWDBBIQCWNAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-11-9-13(16)10-14(17)15(11)8-7-12-5-3-2-4-6-12/h2-6,9-10,16H,7-8H2,1H3.
What are the key properties of 4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one?
4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one has a molecular weight of 229.28 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2-one is sourced from PubChem (CID 54694339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).