2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one

C15H20F2N2OS — CID 83263534

IUPAC2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
SMILESCCC1(C)NC(c2ccc(F)cc2F)N(CCSC)C1=O
InChIInChI=1S/C15H20F2N2OS/c1-4-15(2)14(20)19(7-8-21-3)13(18-15)11-6-5-10(16)9-12(11)17/h5-6,9,13,18H,4,7-8H2,1-3H3
InChIKeyXFSNDLFJCGCCQT-UHFFFAOYSA-N
MW314.40 g/mol
LogP2.93
Rot. Bonds5

About 2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one

2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one (PubChem CID 83263534) has the molecular formula C15H20F2N2OS and a molecular weight of 314.40 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
PubChem CID83263534
Molecular FormulaC15H20F2N2OS
Molecular Weight314.40 g/mol
Exact Mass314.13
IUPAC Name2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
SMILESCCC1(C)NC(c2ccc(F)cc2F)N(CCSC)C1=O
InChIInChI=1S/C15H20F2N2OS/c1-4-15(2)14(20)19(7-8-21-3)13(18-15)11-6-5-10(16)9-12(11)17/h5-6,9,13,18H,4,7-8H2,1-3H3
InChIKeyXFSNDLFJCGCCQT-UHFFFAOYSA-N
XLogP2.93
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83256949
5-ethyl-2-(3-methoxyphenyl)-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83263533
3-(2-ethoxyethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one
CID 83233386
3,5-diethyl-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
CID 83238688
5-ethyl-5-methyl-2-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83258114
2-(3-fluorophenyl)-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83257620
2-(4-fluorophenyl)-3-(2-methylsulfanylethyl)-5-propylimidazolidin-4-one
CID 83257869
5-(2,4-difluorophenyl)-6-(2,2-dimethylcyclopropyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83248621
5-ethyl-3,5-dimethyl-2-(4-methylsulfanylphenyl)imidazolidin-4-one
CID 83261202
3-butyl-2-(2,4-difluorophenyl)imidazolidin-4-one
CID 83238048
2-(4-chlorophenyl)-3-(2-ethoxyethyl)-5-ethyl-5-methylimidazolidin-4-one
CID 83232560
2-(2,5-dimethylphenyl)-3,5-diethyl-5-methylimidazolidin-4-one
CID 83239174

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one?
The IUPAC name of 2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one (CID 83263534) is 2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one.
What is the SMILES notation for 2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one?
The canonical SMILES for 2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one is CCC1(C)NC(c2ccc(F)cc2F)N(CCSC)C1=O.
What is the InChIKey of 2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one?
The InChIKey is XFSNDLFJCGCCQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2OS/c1-4-15(2)14(20)19(7-8-21-3)13(18-15)11-6-5-10(16)9-12(11)17/h5-6,9,13,18H,4,7-8H2,1-3H3.
What are the key properties of 2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one?
2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one has a molecular weight of 314.40 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-5-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one is sourced from PubChem (CID 83263534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).