(E)-5-fluoropent-4-en-2-one

C5H7FO — CID 87633698

IUPAC(E)-5-fluoropent-4-en-2-one
SMILESCC(=O)C/C=C/F
InChIInChI=1S/C5H7FO/c1-5(7)3-2-4-6/h2,4H,3H2,1H3/b4-2+
InChIKeyAIWVHANKLGWXLZ-DUXPYHPUSA-N
MW102.11 g/mol
LogP1.45
Rot. Bonds2

About (E)-5-fluoropent-4-en-2-one

(E)-5-fluoropent-4-en-2-one (PubChem CID 87633698) has the molecular formula C5H7FO and a molecular weight of 102.11 g/mol. Its IUPAC name is (E)-5-fluoropent-4-en-2-one.

Molecular Properties

Compound Name(E)-5-fluoropent-4-en-2-one
PubChem CID87633698
Molecular FormulaC5H7FO
Molecular Weight102.11 g/mol
Exact Mass102.05
IUPAC Name(E)-5-fluoropent-4-en-2-one
SMILESCC(=O)C/C=C/F
InChIInChI=1S/C5H7FO/c1-5(7)3-2-4-6/h2,4H,3H2,1H3/b4-2+
InChIKeyAIWVHANKLGWXLZ-DUXPYHPUSA-N
XLogP1.45
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.11
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (E)-5-fluoropent-4-en-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Penten-2-one
CID 83797
5-Hexen-3-one
CID 141082
3-Fluoro-5-hexen-2-one
CID 13551025
But-3-enoyl fluoride
CID 11073342
4-Pentenoyl fluoride
CID 12099417
5,5,5-Trifluoro-1-penten-4-one
CID 62962421
3,5,5-Trifluoropent-4-en-2-one
CID 87494793
3,5-Difluorohepta-1,6-dien-4-one
CID 88337466
2-Oxopent-4-enoyl fluoride
CID 88403320
5-Fluoropent-4-en-2-one
CID 91046926
(E)-1-fluoropent-1-en-3-one
CID 118189837
3,3-Difluoropent-4-en-2-one
CID 123479291

Frequently Asked Questions

What is the IUPAC name of (E)-5-fluoropent-4-en-2-one?
The IUPAC name of (E)-5-fluoropent-4-en-2-one (CID 87633698) is (E)-5-fluoropent-4-en-2-one.
What is the SMILES notation for (E)-5-fluoropent-4-en-2-one?
The canonical SMILES for (E)-5-fluoropent-4-en-2-one is CC(=O)C/C=C/F.
What is the InChIKey of (E)-5-fluoropent-4-en-2-one?
The InChIKey is AIWVHANKLGWXLZ-DUXPYHPUSA-N. The full InChI is InChI=1S/C5H7FO/c1-5(7)3-2-4-6/h2,4H,3H2,1H3/b4-2+.
What are the key properties of (E)-5-fluoropent-4-en-2-one?
(E)-5-fluoropent-4-en-2-one has a molecular weight of 102.11 g/mol, XLogP of 1.45, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-fluoropent-4-en-2-one is sourced from PubChem (CID 87633698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).