3-(fluoroamino)-1-methylpyrrolidine-2,5-dione

C5H7FN2O2 — CID 88997669

IUPAC3-(fluoroamino)-1-methylpyrrolidine-2,5-dione
SMILESCN1C(=O)CC(NF)C1=O
InChIInChI=1S/C5H7FN2O2/c1-8-4(9)2-3(7-6)5(8)10/h3,7H,2H2,1H3
InChIKeyCHVDIUOHNOTKRK-UHFFFAOYSA-N
MW146.12 g/mol
LogP-0.78
Rot. Bonds1

About 3-(fluoroamino)-1-methylpyrrolidine-2,5-dione

3-(fluoroamino)-1-methylpyrrolidine-2,5-dione (PubChem CID 88997669) has the molecular formula C5H7FN2O2 and a molecular weight of 146.12 g/mol. Its IUPAC name is 3-(fluoroamino)-1-methylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-(fluoroamino)-1-methylpyrrolidine-2,5-dione
PubChem CID88997669
Molecular FormulaC5H7FN2O2
Molecular Weight146.12 g/mol
Exact Mass146.05
IUPAC Name3-(fluoroamino)-1-methylpyrrolidine-2,5-dione
SMILESCN1C(=O)CC(NF)C1=O
InChIInChI=1S/C5H7FN2O2/c1-8-4(9)2-3(7-6)5(8)10/h3,7H,2H2,1H3
InChIKeyCHVDIUOHNOTKRK-UHFFFAOYSA-N
XLogP-0.78
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.12
LogP ≤ 5-0.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-(fluoroamino)-1-methylpyrrolidine-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

Frequently Asked Questions

What is the IUPAC name of 3-(fluoroamino)-1-methylpyrrolidine-2,5-dione?
The IUPAC name of 3-(fluoroamino)-1-methylpyrrolidine-2,5-dione (CID 88997669) is 3-(fluoroamino)-1-methylpyrrolidine-2,5-dione.
What is the SMILES notation for 3-(fluoroamino)-1-methylpyrrolidine-2,5-dione?
The canonical SMILES for 3-(fluoroamino)-1-methylpyrrolidine-2,5-dione is CN1C(=O)CC(NF)C1=O.
What is the InChIKey of 3-(fluoroamino)-1-methylpyrrolidine-2,5-dione?
The InChIKey is CHVDIUOHNOTKRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7FN2O2/c1-8-4(9)2-3(7-6)5(8)10/h3,7H,2H2,1H3.
What are the key properties of 3-(fluoroamino)-1-methylpyrrolidine-2,5-dione?
3-(fluoroamino)-1-methylpyrrolidine-2,5-dione has a molecular weight of 146.12 g/mol, XLogP of -0.78, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(fluoroamino)-1-methylpyrrolidine-2,5-dione is sourced from PubChem (CID 88997669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).