4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one

C9H10FNO — CID 89344172

IUPAC4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one
SMILESC=CC1=C(/C=C\CF)CNC1=O
InChIInChI=1S/C9H10FNO/c1-2-8-7(4-3-5-10)6-11-9(8)12/h2-4H,1,5-6H2,(H,11,12)/b4-3-
InChIKeyWVPROARCDFBVDD-ARJAWSKDSA-N
MW167.18 g/mol
LogP1.12
Rot. Bonds3

About 4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one

4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one (PubChem CID 89344172) has the molecular formula C9H10FNO and a molecular weight of 167.18 g/mol. Its IUPAC name is 4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one.

Molecular Properties

Compound Name4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one
PubChem CID89344172
Molecular FormulaC9H10FNO
Molecular Weight167.18 g/mol
Exact Mass167.07
IUPAC Name4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one
SMILESC=CC1=C(/C=C\CF)CNC1=O
InChIInChI=1S/C9H10FNO/c1-2-8-7(4-3-5-10)6-11-9(8)12/h2-4H,1,5-6H2,(H,11,12)/b4-3-
InChIKeyWVPROARCDFBVDD-ARJAWSKDSA-N
XLogP1.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.18
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one?
The IUPAC name of 4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one (CID 89344172) is 4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one.
What is the SMILES notation for 4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one?
The canonical SMILES for 4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one is C=CC1=C(/C=C\CF)CNC1=O.
What is the InChIKey of 4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one?
The InChIKey is WVPROARCDFBVDD-ARJAWSKDSA-N. The full InChI is InChI=1S/C9H10FNO/c1-2-8-7(4-3-5-10)6-11-9(8)12/h2-4H,1,5-6H2,(H,11,12)/b4-3-.
What are the key properties of 4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one?
4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one has a molecular weight of 167.18 g/mol, XLogP of 1.12, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-3-[(Z)-3-fluoroprop-1-enyl]-1,2-dihydropyrrol-5-one is sourced from PubChem (CID 89344172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).