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

C15H11F2NO2 — CID 135016755

IUPAC3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1ccccc1-c1ccc(F)c(F)c1
InChIInChI=1S/C15H11F2NO2/c16-12-6-5-10(9-13(12)17)11-3-1-2-4-14(11)18-7-8-20-15(18)19/h1-6,9H,7-8H2
InChIKeyLCGMPMIIOJUKEE-UHFFFAOYSA-N
MW275.25 g/mol
LogP3.59
Rot. Bonds2

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

3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one (PubChem CID 135016755) has the molecular formula C15H11F2NO2 and a molecular weight of 275.25 g/mol. Its IUPAC name is 3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one
PubChem CID135016755
Molecular FormulaC15H11F2NO2
Molecular Weight275.25 g/mol
Exact Mass275.08
IUPAC Name3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1ccccc1-c1ccc(F)c(F)c1
InChIInChI=1S/C15H11F2NO2/c16-12-6-5-10(9-13(12)17)11-3-1-2-4-14(11)18-7-8-20-15(18)19/h1-6,9H,7-8H2
InChIKeyLCGMPMIIOJUKEE-UHFFFAOYSA-N
XLogP3.59
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.25
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one (CID 135016755) is 3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one is O=C1OCCN1c1ccccc1-c1ccc(F)c(F)c1.
What is the InChIKey of 3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one?
The InChIKey is LCGMPMIIOJUKEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F2NO2/c16-12-6-5-10(9-13(12)17)11-3-1-2-4-14(11)18-7-8-20-15(18)19/h1-6,9H,7-8H2.
What are the key properties of 3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one?
3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one has a molecular weight of 275.25 g/mol, XLogP of 3.59, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3,4-difluorophenyl)phenyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 135016755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).