5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one

C13H13F3N2O — CID 106216241

IUPAC5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one
SMILESO=C1C(c2ccccc2)NCN1C1(C(F)(F)F)CC1
InChIInChI=1S/C13H13F3N2O/c14-13(15,16)12(6-7-12)18-8-17-10(11(18)19)9-4-2-1-3-5-9/h1-5,10,17H,6-8H2
InChIKeyHWWORXFXLPEBEN-UHFFFAOYSA-N
MW270.25 g/mol
LogP2.21
Rot. Bonds2

About 5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one

5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one (PubChem CID 106216241) has the molecular formula C13H13F3N2O and a molecular weight of 270.25 g/mol. Its IUPAC name is 5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one.

Molecular Properties

Compound Name5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one
PubChem CID106216241
Molecular FormulaC13H13F3N2O
Molecular Weight270.25 g/mol
Exact Mass270.10
IUPAC Name5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one
SMILESO=C1C(c2ccccc2)NCN1C1(C(F)(F)F)CC1
InChIInChI=1S/C13H13F3N2O/c14-13(15,16)12(6-7-12)18-8-17-10(11(18)19)9-4-2-1-3-5-9/h1-5,10,17H,6-8H2
InChIKeyHWWORXFXLPEBEN-UHFFFAOYSA-N
XLogP2.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.25
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-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 5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one?
The IUPAC name of 5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one (CID 106216241) is 5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one.
What is the SMILES notation for 5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one?
The canonical SMILES for 5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one is O=C1C(c2ccccc2)NCN1C1(C(F)(F)F)CC1.
What is the InChIKey of 5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one?
The InChIKey is HWWORXFXLPEBEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13F3N2O/c14-13(15,16)12(6-7-12)18-8-17-10(11(18)19)9-4-2-1-3-5-9/h1-5,10,17H,6-8H2.
What are the key properties of 5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one?
5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one has a molecular weight of 270.25 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-3-[1-(trifluoromethyl)cyclopropyl]imidazolidin-4-one is sourced from PubChem (CID 106216241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).