(4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one

C10H11NO3 — CID 131102376

IUPAC(4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one
SMILESCN1O[C@@H](c2ccccc2)[C@H](O)C1=O
InChIInChI=1S/C10H11NO3/c1-11-10(13)8(12)9(14-11)7-5-3-2-4-6-7/h2-6,8-9,12H,1H3/t8-,9-/m0/s1
InChIKeyOYYNXFUEJFERES-IUCAKERBSA-N
MW193.20 g/mol
LogP0.49
Rot. Bonds1

About (4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one

(4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one (PubChem CID 131102376) has the molecular formula C10H11NO3 and a molecular weight of 193.20 g/mol. Its IUPAC name is (4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one.

Molecular Properties

Compound Name(4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one
PubChem CID131102376
Molecular FormulaC10H11NO3
Molecular Weight193.20 g/mol
Exact Mass193.07
IUPAC Name(4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one
SMILESCN1O[C@@H](c2ccccc2)[C@H](O)C1=O
InChIInChI=1S/C10H11NO3/c1-11-10(13)8(12)9(14-11)7-5-3-2-4-6-7/h2-6,8-9,12H,1H3/t8-,9-/m0/s1
InChIKeyOYYNXFUEJFERES-IUCAKERBSA-N
XLogP0.49
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one?
The IUPAC name of (4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one (CID 131102376) is (4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one.
What is the SMILES notation for (4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one?
The canonical SMILES for (4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one is CN1O[C@@H](c2ccccc2)[C@H](O)C1=O.
What is the InChIKey of (4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one?
The InChIKey is OYYNXFUEJFERES-IUCAKERBSA-N. The full InChI is InChI=1S/C10H11NO3/c1-11-10(13)8(12)9(14-11)7-5-3-2-4-6-7/h2-6,8-9,12H,1H3/t8-,9-/m0/s1.
What are the key properties of (4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one?
(4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one has a molecular weight of 193.20 g/mol, XLogP of 0.49, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5S)-4-hydroxy-2-methyl-5-phenyl-1,2-oxazolidin-3-one is sourced from PubChem (CID 131102376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).