3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione

C16H12F2N2O2 — CID 43844737

IUPAC3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione
SMILESO=C1CC(Nc2ccccc2F)C(=O)N1c1cccc(F)c1
InChIInChI=1S/C16H12F2N2O2/c17-10-4-3-5-11(8-10)20-15(21)9-14(16(20)22)19-13-7-2-1-6-12(13)18/h1-8,14,19H,9H2
InChIKeyXSBIXSGGDVYBIX-UHFFFAOYSA-N
MW302.28 g/mol
LogP2.71
Rot. Bonds3

About 3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione

3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione (PubChem CID 43844737) has the molecular formula C16H12F2N2O2 and a molecular weight of 302.28 g/mol. Its IUPAC name is 3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione
PubChem CID43844737
Molecular FormulaC16H12F2N2O2
Molecular Weight302.28 g/mol
Exact Mass302.09
IUPAC Name3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione
SMILESO=C1CC(Nc2ccccc2F)C(=O)N1c1cccc(F)c1
InChIInChI=1S/C16H12F2N2O2/c17-10-4-3-5-11(8-10)20-15(21)9-14(16(20)22)19-13-7-2-1-6-12(13)18/h1-8,14,19H,9H2
InChIKeyXSBIXSGGDVYBIX-UHFFFAOYSA-N
XLogP2.71
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.28
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione 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

1-(3,4-dichlorophenyl)-3-(2-fluoroanilino)pyrrolidine-2,5-dione
CID 43844934
(3S)-1-(4-ethylphenyl)-3-(2-fluoroanilino)pyrrolidine-2,5-dione
CID 51860070
3-(3-fluoroanilino)-1-phenylpyrrolidine-2,5-dione
CID 43410376
(3R)-1-(2,6-dimethylphenyl)-3-(2-fluoroanilino)pyrrolidine-2,5-dione
CID 98188016
3-(3,4-dimethylanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione
CID 43844727
(3S)-3-(2-fluoroanilino)-1-(2,4,6-trimethylphenyl)pyrrolidine-2,5-dione
CID 51860019
1-(3-chlorophenyl)-3-(3-fluoroanilino)pyrrolidine-2,5-dione
CID 43844800
1-(2-chlorophenyl)-3-(2-fluoroanilino)pyrrolidine-2,5-dione
CID 43844780
(3R)-1-(2,3-dichlorophenyl)-3-(2-fluoroanilino)pyrrolidine-2,5-dione
CID 51860353
3-(2-hydroxyanilino)-1-(3-methylphenyl)pyrrolidine-2,5-dione
CID 19163658
(3S)-3-(2-chloroanilino)-1-(3-methylphenyl)pyrrolidine-2,5-dione
CID 51859864
1-(3-hydroxyphenyl)-3-[2-(trifluoromethyl)anilino]pyrrolidine-2,5-dione
CID 43826677

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione?
The IUPAC name of 3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione (CID 43844737) is 3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione?
The canonical SMILES for 3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione is O=C1CC(Nc2ccccc2F)C(=O)N1c1cccc(F)c1.
What is the InChIKey of 3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione?
The InChIKey is XSBIXSGGDVYBIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F2N2O2/c17-10-4-3-5-11(8-10)20-15(21)9-14(16(20)22)19-13-7-2-1-6-12(13)18/h1-8,14,19H,9H2.
What are the key properties of 3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione?
3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione has a molecular weight of 302.28 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoroanilino)-1-(3-fluorophenyl)pyrrolidine-2,5-dione is sourced from PubChem (CID 43844737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).