3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one

C15H19F3N2O — CID 83238790

IUPAC3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one
SMILESCCN1C(=O)C(C)(CC)NC1c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H19F3N2O/c1-4-14(3)13(21)20(5-2)12(19-14)10-6-8-11(9-7-10)15(16,17)18/h6-9,12,19H,4-5H2,1-3H3
InChIKeyKJGMYKIZPUKIOP-UHFFFAOYSA-N
MW300.32 g/mol
LogP3.32
Rot. Bonds3

About 3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one

3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one (PubChem CID 83238790) has the molecular formula C15H19F3N2O and a molecular weight of 300.32 g/mol. Its IUPAC name is 3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one.

Molecular Properties

Compound Name3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one
PubChem CID83238790
Molecular FormulaC15H19F3N2O
Molecular Weight300.32 g/mol
Exact Mass300.14
IUPAC Name3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one
SMILESCCN1C(=O)C(C)(CC)NC1c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H19F3N2O/c1-4-14(3)13(21)20(5-2)12(19-14)10-6-8-11(9-7-10)15(16,17)18/h6-9,12,19H,4-5H2,1-3H3
InChIKeyKJGMYKIZPUKIOP-UHFFFAOYSA-N
XLogP3.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-diethyl-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
CID 83238688
3-ethyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one
CID 115282048
3,5-diethyl-5-methyl-2-thiophen-2-ylimidazolidin-4-one
CID 83238689
5-ethyl-5-methyl-2-(2-methylphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
CID 83244950
2-(2,5-dimethylphenyl)-3,5-diethyl-5-methylimidazolidin-4-one
CID 83239174
2-(4-chlorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83256949
2-(4-chlorophenyl)-3-(2-ethoxyethyl)-5-ethyl-5-methylimidazolidin-4-one
CID 83232560
5-ethyl-3-(2-methoxypropyl)-5-methyl-2-phenylimidazolidin-4-one
CID 102702062
2-(4-chlorophenyl)-5-ethyl-3,5-dimethylimidazolidin-4-one
CID 83260669
5-ethyl-2-(4-fluorophenyl)-5-methyl-3-(3-methylbutan-2-yl)imidazolidin-4-one
CID 83248492
5-ethyl-5-methyl-3-(2,2,3,3-tetrafluoropropyl)-2-thiophen-2-ylimidazolidin-4-one
CID 106291416
5-ethyl-5-methyl-2-(5-methylthiophen-2-yl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one
CID 83248709

Frequently Asked Questions

What is the IUPAC name of 3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one?
The IUPAC name of 3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one (CID 83238790) is 3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one.
What is the SMILES notation for 3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one?
The canonical SMILES for 3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one is CCN1C(=O)C(C)(CC)NC1c1ccc(C(F)(F)F)cc1.
What is the InChIKey of 3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one?
The InChIKey is KJGMYKIZPUKIOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2O/c1-4-14(3)13(21)20(5-2)12(19-14)10-6-8-11(9-7-10)15(16,17)18/h6-9,12,19H,4-5H2,1-3H3.
What are the key properties of 3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one?
3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one has a molecular weight of 300.32 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one is sourced from PubChem (CID 83238790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).