1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one

C13H13NO2 — CID 36689704

IUPAC1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one
SMILESO=c1ccccn1C[C@@H](O)c1ccccc1
InChIInChI=1S/C13H13NO2/c15-12(11-6-2-1-3-7-11)10-14-9-5-4-8-13(14)16/h1-9,12,15H,10H2/t12-/m1/s1
InChIKeyCENOWDVPZXIWRL-GFCCVEGCSA-N
MW215.25 g/mol
LogP1.58
Rot. Bonds3

About 1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one

1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one (PubChem CID 36689704) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is 1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one.

Molecular Properties

Compound Name1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one
PubChem CID36689704
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Name1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one
SMILESO=c1ccccn1C[C@@H](O)c1ccccc1
InChIInChI=1S/C13H13NO2/c15-12(11-6-2-1-3-7-11)10-14-9-5-4-8-13(14)16/h1-9,12,15H,10H2/t12-/m1/s1
InChIKeyCENOWDVPZXIWRL-GFCCVEGCSA-N
XLogP1.58
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-amino-2-phenylethyl)pyridin-2-one
CID 16783269
1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride
CID 91662965
1-(2-hydroxy-2-phenylethyl)-4-methylpyridin-2-one
CID 55153499
3-(2-hydroxy-2-phenylethyl)pyrimidin-4-one
CID 63769900
2-(2-imino-1-pyridinyl)-1-phenylethanol
CID 2801660
2-methyl-3-(2-oxo-1-pyridinyl)propanoic acid
CID 60773689
1,3-bis(2-hydroxy-2-phenylethyl)benzimidazol-2-one
CID 21492519
4-[[2-(2-oxo-1-pyridinyl)-1-phenylethyl]carbamoylamino]butanoic acid
CID 122013493
N-[(1R)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-3-carboxamide
CID 100735320
(1R)-1-phenyl-2-pyrazol-1-ylethanol
CID 712326
4-methyl-2-[(2-oxo-1-pyridinyl)methyl]pentanoic acid
CID 153352831
N-[(2S)-2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-phenylacetamide
CID 99903624

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one?
The IUPAC name of 1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one (CID 36689704) is 1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one.
What is the SMILES notation for 1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one?
The canonical SMILES for 1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one is O=c1ccccn1C[C@@H](O)c1ccccc1.
What is the InChIKey of 1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one?
The InChIKey is CENOWDVPZXIWRL-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H13NO2/c15-12(11-6-2-1-3-7-11)10-14-9-5-4-8-13(14)16/h1-9,12,15H,10H2/t12-/m1/s1.
What are the key properties of 1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one?
1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one has a molecular weight of 215.25 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one is sourced from PubChem (CID 36689704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).