5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one

C14H17F3N2O — CID 83251359

IUPAC5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
SMILESCCC1NC(c2ccccc2C)N(CC(F)(F)F)C1=O
InChIInChI=1S/C14H17F3N2O/c1-3-11-13(20)19(8-14(15,16)17)12(18-11)10-7-5-4-6-9(10)2/h4-7,11-12,18H,3,8H2,1-2H3
InChIKeyOKWOBVBXWODPCJ-UHFFFAOYSA-N
MW286.30 g/mol
LogP2.77
Rot. Bonds3

About 5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one

5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one (PubChem CID 83251359) has the molecular formula C14H17F3N2O and a molecular weight of 286.30 g/mol. Its IUPAC name is 5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
PubChem CID83251359
Molecular FormulaC14H17F3N2O
Molecular Weight286.30 g/mol
Exact Mass286.13
IUPAC Name5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
SMILESCCC1NC(c2ccccc2C)N(CC(F)(F)F)C1=O
InChIInChI=1S/C14H17F3N2O/c1-3-11-13(20)19(8-14(15,16)17)12(18-11)10-7-5-4-6-9(10)2/h4-7,11-12,18H,3,8H2,1-2H3
InChIKeyOKWOBVBXWODPCJ-UHFFFAOYSA-N
XLogP2.77
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.30
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)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-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one?
The IUPAC name of 5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one (CID 83251359) is 5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one.
What is the SMILES notation for 5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one?
The canonical SMILES for 5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one is CCC1NC(c2ccccc2C)N(CC(F)(F)F)C1=O.
What is the InChIKey of 5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one?
The InChIKey is OKWOBVBXWODPCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3N2O/c1-3-11-13(20)19(8-14(15,16)17)12(18-11)10-7-5-4-6-9(10)2/h4-7,11-12,18H,3,8H2,1-2H3.
What are the key properties of 5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one?
5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one has a molecular weight of 286.30 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one is sourced from PubChem (CID 83251359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).