1-benzyl-3-hydroxypyridin-2-one

C12H11NO2 — CID 22339931

IUPAC1-benzyl-3-hydroxypyridin-2-one
SMILESO=c1c(O)cccn1Cc1ccccc1
InChIInChI=1S/C12H11NO2/c14-11-7-4-8-13(12(11)15)9-10-5-2-1-3-6-10/h1-8,14H,9H2
InChIKeyYYOJBSBLTSAPCS-UHFFFAOYSA-N
MW201.22 g/mol
LogP1.60
Rot. Bonds2

About 1-benzyl-3-hydroxypyridin-2-one

1-benzyl-3-hydroxypyridin-2-one (PubChem CID 22339931) has the molecular formula C12H11NO2 and a molecular weight of 201.22 g/mol. Its IUPAC name is 1-benzyl-3-hydroxypyridin-2-one.

Molecular Properties

Compound Name1-benzyl-3-hydroxypyridin-2-one
PubChem CID22339931
Molecular FormulaC12H11NO2
Molecular Weight201.22 g/mol
Exact Mass201.08
IUPAC Name1-benzyl-3-hydroxypyridin-2-one
SMILESO=c1c(O)cccn1Cc1ccccc1
InChIInChI=1S/C12H11NO2/c14-11-7-4-8-13(12(11)15)9-10-5-2-1-3-6-10/h1-8,14H,9H2
InChIKeyYYOJBSBLTSAPCS-UHFFFAOYSA-N
XLogP1.60
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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3-Hydroxy-2-methyl-1-(phenylmethyl)-4(1H)-pyridinone
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1-Benzyl-6-hydroxy-4-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
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1-Benzyl-1,2-dihydropyridin-2-one
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Nsc167484
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1-Benzyl-4-hexylpyridin-2-one
CID 121493777
6-(4-fluorophenyl)-3-hydroxy-1H-pyridin-2-one
CID 72204357
1-Methyl-6-phenylpyridin-2-one
CID 739288
1-Benzyl-5-hydroxy-2-methylpyridin-4-one
CID 123130720
1-Benzyl-3-hydroxy-4-[(1-phenylethylamino)methyl]pyridin-2-one
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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-hydroxypyridin-2-one?
The IUPAC name of 1-benzyl-3-hydroxypyridin-2-one (CID 22339931) is 1-benzyl-3-hydroxypyridin-2-one.
What is the SMILES notation for 1-benzyl-3-hydroxypyridin-2-one?
The canonical SMILES for 1-benzyl-3-hydroxypyridin-2-one is O=c1c(O)cccn1Cc1ccccc1.
What is the InChIKey of 1-benzyl-3-hydroxypyridin-2-one?
The InChIKey is YYOJBSBLTSAPCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2/c14-11-7-4-8-13(12(11)15)9-10-5-2-1-3-6-10/h1-8,14H,9H2.
What are the key properties of 1-benzyl-3-hydroxypyridin-2-one?
1-benzyl-3-hydroxypyridin-2-one has a molecular weight of 201.22 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-hydroxypyridin-2-one is sourced from PubChem (CID 22339931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).