3-ethyl-4-phenyl-1,3-oxazolidin-2-one

C11H13NO2 — CID 72619042

IUPAC3-ethyl-4-phenyl-1,3-oxazolidin-2-one
SMILESCCN1C(=O)OCC1c1ccccc1
InChIInChI=1S/C11H13NO2/c1-2-12-10(8-14-11(12)13)9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3
InChIKeyABLVYLHFGAZFPW-UHFFFAOYSA-N
MW191.23 g/mol
LogP2.20
Rot. Bonds2

About 3-ethyl-4-phenyl-1,3-oxazolidin-2-one

3-ethyl-4-phenyl-1,3-oxazolidin-2-one (PubChem CID 72619042) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is 3-ethyl-4-phenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-ethyl-4-phenyl-1,3-oxazolidin-2-one
PubChem CID72619042
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name3-ethyl-4-phenyl-1,3-oxazolidin-2-one
SMILESCCN1C(=O)OCC1c1ccccc1
InChIInChI=1S/C11H13NO2/c1-2-12-10(8-14-11(12)13)9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3
InChIKeyABLVYLHFGAZFPW-UHFFFAOYSA-N
XLogP2.20
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-phenyl-1,3-oxazolidin-2-one?
The IUPAC name of 3-ethyl-4-phenyl-1,3-oxazolidin-2-one (CID 72619042) is 3-ethyl-4-phenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-ethyl-4-phenyl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-ethyl-4-phenyl-1,3-oxazolidin-2-one is CCN1C(=O)OCC1c1ccccc1.
What is the InChIKey of 3-ethyl-4-phenyl-1,3-oxazolidin-2-one?
The InChIKey is ABLVYLHFGAZFPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c1-2-12-10(8-14-11(12)13)9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3.
What are the key properties of 3-ethyl-4-phenyl-1,3-oxazolidin-2-one?
3-ethyl-4-phenyl-1,3-oxazolidin-2-one has a molecular weight of 191.23 g/mol, XLogP of 2.20, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-phenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 72619042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).