3-(1-fluoroethenyl)-1,3-oxazolidin-2-one

C5H6FNO2 — CID 146636667

IUPAC3-(1-fluoroethenyl)-1,3-oxazolidin-2-one
SMILESC=C(F)N1CCOC1=O
InChIInChI=1S/C5H6FNO2/c1-4(6)7-2-3-9-5(7)8/h1-3H2
InChIKeyFIUCZNOSKVRUPX-UHFFFAOYSA-N
MW131.11 g/mol
LogP0.88
Rot. Bonds1

About 3-(1-fluoroethenyl)-1,3-oxazolidin-2-one

3-(1-fluoroethenyl)-1,3-oxazolidin-2-one (PubChem CID 146636667) has the molecular formula C5H6FNO2 and a molecular weight of 131.11 g/mol. Its IUPAC name is 3-(1-fluoroethenyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(1-fluoroethenyl)-1,3-oxazolidin-2-one
PubChem CID146636667
Molecular FormulaC5H6FNO2
Molecular Weight131.11 g/mol
Exact Mass131.04
IUPAC Name3-(1-fluoroethenyl)-1,3-oxazolidin-2-one
SMILESC=C(F)N1CCOC1=O
InChIInChI=1S/C5H6FNO2/c1-4(6)7-2-3-9-5(7)8/h1-3H2
InChIKeyFIUCZNOSKVRUPX-UHFFFAOYSA-N
XLogP0.88
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.11
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(1-fluoroethenyl)-1,3-oxazolidin-2-one?
The IUPAC name of 3-(1-fluoroethenyl)-1,3-oxazolidin-2-one (CID 146636667) is 3-(1-fluoroethenyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(1-fluoroethenyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(1-fluoroethenyl)-1,3-oxazolidin-2-one is C=C(F)N1CCOC1=O.
What is the InChIKey of 3-(1-fluoroethenyl)-1,3-oxazolidin-2-one?
The InChIKey is FIUCZNOSKVRUPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6FNO2/c1-4(6)7-2-3-9-5(7)8/h1-3H2.
What are the key properties of 3-(1-fluoroethenyl)-1,3-oxazolidin-2-one?
3-(1-fluoroethenyl)-1,3-oxazolidin-2-one has a molecular weight of 131.11 g/mol, XLogP of 0.88, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-fluoroethenyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 146636667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).