2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one

C13H15ClF2N2O — CID 83270330

IUPAC2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one
SMILESCCC1NC(c2cccc(Cl)c2)N(CC(F)F)C1=O
InChIInChI=1S/C13H15ClF2N2O/c1-2-10-13(19)18(7-11(15)16)12(17-10)8-4-3-5-9(14)6-8/h3-6,10-12,17H,2,7H2,1H3
InChIKeyYWGVEBZZLPWKBN-UHFFFAOYSA-N
MW288.73 g/mol
LogP2.81
Rot. Bonds4

About 2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one

2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one (PubChem CID 83270330) has the molecular formula C13H15ClF2N2O and a molecular weight of 288.73 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one.

Molecular Properties

Compound Name2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one
PubChem CID83270330
Molecular FormulaC13H15ClF2N2O
Molecular Weight288.73 g/mol
Exact Mass288.08
IUPAC Name2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one
SMILESCCC1NC(c2cccc(Cl)c2)N(CC(F)F)C1=O
InChIInChI=1S/C13H15ClF2N2O/c1-2-10-13(19)18(7-11(15)16)12(17-10)8-4-3-5-9(14)6-8/h3-6,10-12,17H,2,7H2,1H3
InChIKeyYWGVEBZZLPWKBN-UHFFFAOYSA-N
XLogP2.81
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.73
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)-3-(cyclopentylmethyl)-5-ethylimidazolidin-4-one
CID 83247552
2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one
CID 83240043
2-(3-chlorophenyl)-5-ethyl-3-(3-methylpentan-2-yl)imidazolidin-4-one
CID 83247620
2-(3-chlorophenyl)-5-ethyl-3-hexan-2-ylimidazolidin-4-one
CID 83252025
5-butyl-3-(2,2-difluoroethyl)-2-phenylimidazolidin-4-one
CID 83270970
2-(3-chlorophenyl)-5-ethyl-3-(2-methylcyclopentyl)imidazolidin-4-one
CID 83264033
2-(3,4-difluorophenyl)-5-ethyl-3-propylimidazolidin-4-one
CID 83241892
2-(4-chlorophenyl)-5-ethyl-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one
CID 83252770
3-(2,2-difluoroethyl)-5-methyl-2-[3-(trifluoromethyl)phenyl]imidazolidin-4-one
CID 83268675
5-butyl-2-(3-chlorophenyl)-3-methylimidazolidin-4-one
CID 83261728
5-ethyl-2-(3-fluorophenyl)-3-(4-methoxybutyl)imidazolidin-4-one
CID 83245843
5-ethyl-2-(2-fluorophenyl)-3-(2-methylpropyl)imidazolidin-4-one
CID 83242658

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one?
The IUPAC name of 2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one (CID 83270330) is 2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one.
What is the SMILES notation for 2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one?
The canonical SMILES for 2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one is CCC1NC(c2cccc(Cl)c2)N(CC(F)F)C1=O.
What is the InChIKey of 2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one?
The InChIKey is YWGVEBZZLPWKBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClF2N2O/c1-2-10-13(19)18(7-11(15)16)12(17-10)8-4-3-5-9(14)6-8/h3-6,10-12,17H,2,7H2,1H3.
What are the key properties of 2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one?
2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one has a molecular weight of 288.73 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-3-(2,2-difluoroethyl)-5-ethylimidazolidin-4-one is sourced from PubChem (CID 83270330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).