4-(fluoromethyl)imidazolidin-2-one

C4H7FN2O — CID 67255577

IUPAC4-(fluoromethyl)imidazolidin-2-one
SMILESO=C1NCC(CF)N1
InChIInChI=1S/C4H7FN2O/c5-1-3-2-6-4(8)7-3/h3H,1-2H2,(H2,6,7,8)
InChIKeyFXCSIPVDJFPHGP-UHFFFAOYSA-N
MW118.11 g/mol
LogP-0.36
Rot. Bonds1

About 4-(fluoromethyl)imidazolidin-2-one

4-(fluoromethyl)imidazolidin-2-one (PubChem CID 67255577) has the molecular formula C4H7FN2O and a molecular weight of 118.11 g/mol. Its IUPAC name is 4-(fluoromethyl)imidazolidin-2-one.

Molecular Properties

Compound Name4-(fluoromethyl)imidazolidin-2-one
PubChem CID67255577
Molecular FormulaC4H7FN2O
Molecular Weight118.11 g/mol
Exact Mass118.05
IUPAC Name4-(fluoromethyl)imidazolidin-2-one
SMILESO=C1NCC(CF)N1
InChIInChI=1S/C4H7FN2O/c5-1-3-2-6-4(8)7-3/h3H,1-2H2,(H2,6,7,8)
InChIKeyFXCSIPVDJFPHGP-UHFFFAOYSA-N
XLogP-0.36
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.11
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 4-(fluoromethyl)imidazolidin-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

Frequently Asked Questions

What is the IUPAC name of 4-(fluoromethyl)imidazolidin-2-one?
The IUPAC name of 4-(fluoromethyl)imidazolidin-2-one (CID 67255577) is 4-(fluoromethyl)imidazolidin-2-one.
What is the SMILES notation for 4-(fluoromethyl)imidazolidin-2-one?
The canonical SMILES for 4-(fluoromethyl)imidazolidin-2-one is O=C1NCC(CF)N1.
What is the InChIKey of 4-(fluoromethyl)imidazolidin-2-one?
The InChIKey is FXCSIPVDJFPHGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7FN2O/c5-1-3-2-6-4(8)7-3/h3H,1-2H2,(H2,6,7,8).
What are the key properties of 4-(fluoromethyl)imidazolidin-2-one?
4-(fluoromethyl)imidazolidin-2-one has a molecular weight of 118.11 g/mol, XLogP of -0.36, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoromethyl)imidazolidin-2-one is sourced from PubChem (CID 67255577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).