3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one

C17H14FNO3 — CID 21266203

IUPAC3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one
SMILESO=C(Cc1ccccc1F)N1C(=O)OCC1c1ccccc1
InChIInChI=1S/C17H14FNO3/c18-14-9-5-4-8-13(14)10-16(20)19-15(11-22-17(19)21)12-6-2-1-3-7-12/h1-9,15H,10-11H2
InChIKeyRNQRPCSUWZDKTQ-UHFFFAOYSA-N
MW299.30 g/mol
LogP3.09
Rot. Bonds3

About 3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one

3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one (PubChem CID 21266203) has the molecular formula C17H14FNO3 and a molecular weight of 299.30 g/mol. Its IUPAC name is 3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one
PubChem CID21266203
Molecular FormulaC17H14FNO3
Molecular Weight299.30 g/mol
Exact Mass299.10
IUPAC Name3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one
SMILESO=C(Cc1ccccc1F)N1C(=O)OCC1c1ccccc1
InChIInChI=1S/C17H14FNO3/c18-14-9-5-4-8-13(14)10-16(20)19-15(11-22-17(19)21)12-6-2-1-3-7-12/h1-9,15H,10-11H2
InChIKeyRNQRPCSUWZDKTQ-UHFFFAOYSA-N
XLogP3.09
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.30
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one?
The IUPAC name of 3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one (CID 21266203) is 3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one is O=C(Cc1ccccc1F)N1C(=O)OCC1c1ccccc1.
What is the InChIKey of 3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one?
The InChIKey is RNQRPCSUWZDKTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO3/c18-14-9-5-4-8-13(14)10-16(20)19-15(11-22-17(19)21)12-6-2-1-3-7-12/h1-9,15H,10-11H2.
What are the key properties of 3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one?
3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one has a molecular weight of 299.30 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-fluorophenyl)acetyl]-4-phenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 21266203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).