3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one

C6H8FNO2 — CID 142959700

IUPAC3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1/C=C/CF
InChIInChI=1S/C6H8FNO2/c7-2-1-3-8-4-5-10-6(8)9/h1,3H,2,4-5H2/b3-1+
InChIKeyIRDZPBHXMNRGDI-HNQUOIGGSA-N
MW145.13 g/mol
LogP0.92
Rot. Bonds2

About 3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one

3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one (PubChem CID 142959700) has the molecular formula C6H8FNO2 and a molecular weight of 145.13 g/mol. Its IUPAC name is 3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one
PubChem CID142959700
Molecular FormulaC6H8FNO2
Molecular Weight145.13 g/mol
Exact Mass145.05
IUPAC Name3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1/C=C/CF
InChIInChI=1S/C6H8FNO2/c7-2-1-3-8-4-5-10-6(8)9/h1,3H,2,4-5H2/b3-1+
InChIKeyIRDZPBHXMNRGDI-HNQUOIGGSA-N
XLogP0.92
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.13
LogP ≤ 50.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one (CID 142959700) is 3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one is O=C1OCCN1/C=C/CF.
What is the InChIKey of 3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one?
The InChIKey is IRDZPBHXMNRGDI-HNQUOIGGSA-N. The full InChI is InChI=1S/C6H8FNO2/c7-2-1-3-8-4-5-10-6(8)9/h1,3H,2,4-5H2/b3-1+.
What are the key properties of 3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one?
3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one has a molecular weight of 145.13 g/mol, XLogP of 0.92, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-3-fluoroprop-1-enyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 142959700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).