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

C9H9NO2 — CID 11252178

IUPAC2-phenyl-1,3-oxazolidin-5-one
SMILESO=C1CNC(c2ccccc2)O1
InChIInChI=1S/C9H9NO2/c11-8-6-10-9(12-8)7-4-2-1-3-5-7/h1-5,9-10H,6H2
InChIKeyKZRYOPZDMMXEJC-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.83
Rot. Bonds1

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

2-phenyl-1,3-oxazolidin-5-one (PubChem CID 11252178) has the molecular formula C9H9NO2 and a molecular weight of 163.18 g/mol. Its IUPAC name is 2-phenyl-1,3-oxazolidin-5-one.

Molecular Properties

Compound Name2-phenyl-1,3-oxazolidin-5-one
PubChem CID11252178
Molecular FormulaC9H9NO2
Molecular Weight163.18 g/mol
Exact Mass163.06
IUPAC Name2-phenyl-1,3-oxazolidin-5-one
SMILESO=C1CNC(c2ccccc2)O1
InChIInChI=1S/C9H9NO2/c11-8-6-10-9(12-8)7-4-2-1-3-5-7/h1-5,9-10H,6H2
InChIKeyKZRYOPZDMMXEJC-UHFFFAOYSA-N
XLogP0.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1,3-oxazolidin-5-one?
The IUPAC name of 2-phenyl-1,3-oxazolidin-5-one (CID 11252178) is 2-phenyl-1,3-oxazolidin-5-one.
What is the SMILES notation for 2-phenyl-1,3-oxazolidin-5-one?
The canonical SMILES for 2-phenyl-1,3-oxazolidin-5-one is O=C1CNC(c2ccccc2)O1.
What is the InChIKey of 2-phenyl-1,3-oxazolidin-5-one?
The InChIKey is KZRYOPZDMMXEJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO2/c11-8-6-10-9(12-8)7-4-2-1-3-5-7/h1-5,9-10H,6H2.
What are the key properties of 2-phenyl-1,3-oxazolidin-5-one?
2-phenyl-1,3-oxazolidin-5-one has a molecular weight of 163.18 g/mol, XLogP of 0.83, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1,3-oxazolidin-5-one is sourced from PubChem (CID 11252178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).