3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one

C9H16F2N2O — CID 83260245

IUPAC3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one
SMILESCCC1(C)NC(C)N(CC(F)F)C1=O
InChIInChI=1S/C9H16F2N2O/c1-4-9(3)8(14)13(5-7(10)11)6(2)12-9/h6-7,12H,4-5H2,1-3H3
InChIKeyLDGMVPMKZLISOQ-UHFFFAOYSA-N
MW206.24 g/mol
LogP1.20
Rot. Bonds3

About 3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one

3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one (PubChem CID 83260245) has the molecular formula C9H16F2N2O and a molecular weight of 206.24 g/mol. Its IUPAC name is 3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one
PubChem CID83260245
Molecular FormulaC9H16F2N2O
Molecular Weight206.24 g/mol
Exact Mass206.12
IUPAC Name3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one
SMILESCCC1(C)NC(C)N(CC(F)F)C1=O
InChIInChI=1S/C9H16F2N2O/c1-4-9(3)8(14)13(5-7(10)11)6(2)12-9/h6-7,12H,4-5H2,1-3H3
InChIKeyLDGMVPMKZLISOQ-UHFFFAOYSA-N
XLogP1.20
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-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

Related Compounds

5-ethyl-2,5-dimethyl-3-(2-methyl-3-pyrrolidin-1-ylpropyl)imidazolidin-4-one
CID 83254520
5-ethyl-2,5-dimethyl-3-(5-methylhexyl)imidazolidin-4-one
CID 83260814
3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one
CID 83237947
5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one
CID 114140888
5-ethyl-2,5-dimethyl-3-(2-thiomorpholin-4-ylethyl)imidazolidin-4-one
CID 106327150
5-ethyl-5-methyl-3-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 83243083
3,5-diethyl-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
CID 83238688
3-cyclopropyl-5-ethyl-2,5-dimethylimidazolidin-4-one
CID 83242982
3-[(1,4-dimethylpiperazin-2-yl)methyl]-5-ethyl-2,5-dimethylimidazolidin-4-one
CID 83264810
5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one
CID 102916100
3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one
CID 83250197
3-(2,3-dimethylbutyl)-5-ethyl-5-methyl-2-propylimidazolidin-4-one
CID 83259462

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one?
The IUPAC name of 3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one (CID 83260245) is 3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one.
What is the SMILES notation for 3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one?
The canonical SMILES for 3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one is CCC1(C)NC(C)N(CC(F)F)C1=O.
What is the InChIKey of 3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one?
The InChIKey is LDGMVPMKZLISOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F2N2O/c1-4-9(3)8(14)13(5-7(10)11)6(2)12-9/h6-7,12H,4-5H2,1-3H3.
What are the key properties of 3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one?
3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one has a molecular weight of 206.24 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one is sourced from PubChem (CID 83260245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).