3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one

C15H18F2N2O — CID 83254392

IUPAC3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one
SMILESCCC1NC(c2ccc(F)c(F)c2)N(C2CCC2)C1=O
InChIInChI=1S/C15H18F2N2O/c1-2-13-15(20)19(10-4-3-5-10)14(18-13)9-6-7-11(16)12(17)8-9/h6-8,10,13-14,18H,2-5H2,1H3
InChIKeyHIXYWUQBZRGRJM-UHFFFAOYSA-N
MW280.32 g/mol
LogP2.73
Rot. Bonds3

About 3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one

3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one (PubChem CID 83254392) has the molecular formula C15H18F2N2O and a molecular weight of 280.32 g/mol. Its IUPAC name is 3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one.

Molecular Properties

Compound Name3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one
PubChem CID83254392
Molecular FormulaC15H18F2N2O
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC Name3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one
SMILESCCC1NC(c2ccc(F)c(F)c2)N(C2CCC2)C1=O
InChIInChI=1S/C15H18F2N2O/c1-2-13-15(20)19(10-4-3-5-10)14(18-13)9-6-7-11(16)12(17)8-9/h6-8,10,13-14,18H,2-5H2,1H3
InChIKeyHIXYWUQBZRGRJM-UHFFFAOYSA-N
XLogP2.73
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopentyl-5-ethyl-2-(4-fluorophenyl)imidazolidin-4-one
CID 83242494
3-cyclobutyl-5-ethyl-2-(4-nitrophenyl)imidazolidin-4-one
CID 83248956
2-(3,4-difluorophenyl)-5-ethyl-3-propylimidazolidin-4-one
CID 83241892
3-cyclohexyl-5-ethyl-2-(2-fluorophenyl)imidazolidin-4-one
CID 83246724
3-cyclopropyl-5-ethyl-2-(4-nitrophenyl)imidazolidin-4-one
CID 83245143
2-(3,4-difluorophenyl)-5-methyl-3-(1-methylpyrrolidin-3-yl)imidazolidin-4-one
CID 83252608
3-cyclopentyl-2-(3,4-difluorophenyl)imidazolidin-4-one
CID 83241965
5-ethyl-2-(4-methylphenyl)-3-(oxan-3-yl)imidazolidin-4-one
CID 83263894
2-(3-chlorophenyl)-5-ethyl-3-(2-methylcyclopentyl)imidazolidin-4-one
CID 83264033
2-(4-chlorophenyl)-3-cyclobutyl-5-methylimidazolidin-4-one
CID 83254897
3-cyclohexyl-5-ethyl-2-(2-methylphenyl)imidazolidin-4-one
CID 83246717
5-ethyl-3-(1-methylpiperidin-3-yl)-2-phenylimidazolidin-4-one
CID 83247325

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one?
The IUPAC name of 3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one (CID 83254392) is 3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one.
What is the SMILES notation for 3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one?
The canonical SMILES for 3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one is CCC1NC(c2ccc(F)c(F)c2)N(C2CCC2)C1=O.
What is the InChIKey of 3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one?
The InChIKey is HIXYWUQBZRGRJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F2N2O/c1-2-13-15(20)19(10-4-3-5-10)14(18-13)9-6-7-11(16)12(17)8-9/h6-8,10,13-14,18H,2-5H2,1H3.
What are the key properties of 3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one?
3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one has a molecular weight of 280.32 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-2-(3,4-difluorophenyl)-5-ethylimidazolidin-4-one is sourced from PubChem (CID 83254392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).