3-methyl-5-phenyl-1,3-oxazolidin-2-one

C10H11NO2 — CID 535587

IUPAC3-methyl-5-phenyl-1,3-oxazolidin-2-one
SMILESCN1CC(c2ccccc2)OC1=O
InChIInChI=1S/C10H11NO2/c1-11-7-9(13-10(11)12)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3
InChIKeyMTEQJQQIAAAKRU-UHFFFAOYSA-N
MW177.20 g/mol
LogP1.81
Rot. Bonds1

About 3-methyl-5-phenyl-1,3-oxazolidin-2-one

3-methyl-5-phenyl-1,3-oxazolidin-2-one (PubChem CID 535587) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 3-methyl-5-phenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-methyl-5-phenyl-1,3-oxazolidin-2-one
PubChem CID535587
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name3-methyl-5-phenyl-1,3-oxazolidin-2-one
SMILESCN1CC(c2ccccc2)OC1=O
InChIInChI=1S/C10H11NO2/c1-11-7-9(13-10(11)12)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3
InChIKeyMTEQJQQIAAAKRU-UHFFFAOYSA-N
XLogP1.81
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-phenyl-1,3-oxazolidin-2-one?
The IUPAC name of 3-methyl-5-phenyl-1,3-oxazolidin-2-one (CID 535587) is 3-methyl-5-phenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-methyl-5-phenyl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-methyl-5-phenyl-1,3-oxazolidin-2-one is CN1CC(c2ccccc2)OC1=O.
What is the InChIKey of 3-methyl-5-phenyl-1,3-oxazolidin-2-one?
The InChIKey is MTEQJQQIAAAKRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-11-7-9(13-10(11)12)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3.
What are the key properties of 3-methyl-5-phenyl-1,3-oxazolidin-2-one?
3-methyl-5-phenyl-1,3-oxazolidin-2-one has a molecular weight of 177.20 g/mol, XLogP of 1.81, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-phenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 535587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).