5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one

C16H14FNO2 — CID 21393572

IUPAC5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one
SMILESO=C1OC(Cc2ccccc2)CN1c1cccc(F)c1
InChIInChI=1S/C16H14FNO2/c17-13-7-4-8-14(10-13)18-11-15(20-16(18)19)9-12-5-2-1-3-6-12/h1-8,10,15H,9,11H2
InChIKeyXLGTXLLTELVTOI-UHFFFAOYSA-N
MW271.29 g/mol
LogP3.39
Rot. Bonds3

About 5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one

5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one (PubChem CID 21393572) has the molecular formula C16H14FNO2 and a molecular weight of 271.29 g/mol. Its IUPAC name is 5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one
PubChem CID21393572
Molecular FormulaC16H14FNO2
Molecular Weight271.29 g/mol
Exact Mass271.10
IUPAC Name5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one
SMILESO=C1OC(Cc2ccccc2)CN1c1cccc(F)c1
InChIInChI=1S/C16H14FNO2/c17-13-7-4-8-14(10-13)18-11-15(20-16(18)19)9-12-5-2-1-3-6-12/h1-8,10,15H,9,11H2
InChIKeyXLGTXLLTELVTOI-UHFFFAOYSA-N
XLogP3.39
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.29
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one?
The IUPAC name of 5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one (CID 21393572) is 5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one is O=C1OC(Cc2ccccc2)CN1c1cccc(F)c1.
What is the InChIKey of 5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one?
The InChIKey is XLGTXLLTELVTOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FNO2/c17-13-7-4-8-14(10-13)18-11-15(20-16(18)19)9-12-5-2-1-3-6-12/h1-8,10,15H,9,11H2.
What are the key properties of 5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one?
5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one has a molecular weight of 271.29 g/mol, XLogP of 3.39, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-3-(3-fluorophenyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 21393572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).