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

C16H24N2OS — CID 83257120

IUPAC2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
SMILESCCC1NC(c2cc(C)ccc2C)N(CCSC)C1=O
InChIInChI=1S/C16H24N2OS/c1-5-14-16(19)18(8-9-20-4)15(17-14)13-10-11(2)6-7-12(13)3/h6-7,10,14-15,17H,5,8-9H2,1-4H3
InChIKeyVHPJRERTQYXLQU-UHFFFAOYSA-N
MW292.45 g/mol
LogP2.88
Rot. Bonds5

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

2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one (PubChem CID 83257120) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
PubChem CID83257120
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC Name2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
SMILESCCC1NC(c2cc(C)ccc2C)N(CCSC)C1=O
InChIInChI=1S/C16H24N2OS/c1-5-14-16(19)18(8-9-20-4)15(17-14)13-10-11(2)6-7-12(13)3/h6-7,10,14-15,17H,5,8-9H2,1-4H3
InChIKeyVHPJRERTQYXLQU-UHFFFAOYSA-N
XLogP2.88
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,5-dimethylphenyl)-3-(2-methylsulfanylethyl)-5-propylimidazolidin-4-one
CID 83263514
2-(2,4-dimethylphenyl)-5-ethyl-3-(3-methylsulfanylpropyl)imidazolidin-4-one
CID 83264334
2-(2,4-dimethylphenyl)-5-ethyl-3-propylimidazolidin-4-one
CID 83242775
2-(2,5-dimethylphenyl)-5-(2-methylpropyl)-3-propylimidazolidin-4-one
CID 83246425
5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one
CID 83256953
2-(2,5-dimethylphenyl)-5-methyl-3-propylimidazolidin-4-one
CID 115282112
2-(2,5-dimethylphenyl)-5-ethyl-3-pentan-2-ylimidazolidin-4-one
CID 83238417
2-(2,5-dimethylphenyl)-5-methyl-3-pentylimidazolidin-4-one
CID 83250805
5-ethyl-2-(2-methoxyphenyl)-3-(3-methylsulfanylpropyl)imidazolidin-4-one
CID 83264187
3,5-diethyl-2-(2-methylphenyl)imidazolidin-4-one
CID 83239063
3-(2-cyclopropylethyl)-5-ethyl-2-(2-methylphenyl)imidazolidin-4-one
CID 83258610
5-ethyl-2-(4-methylsulfanylphenyl)-3-(3-methylsulfanylpropyl)imidazolidin-4-one
CID 83264326

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one?
The IUPAC name of 2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one (CID 83257120) is 2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one?
The canonical SMILES for 2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one is CCC1NC(c2cc(C)ccc2C)N(CCSC)C1=O.
What is the InChIKey of 2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one?
The InChIKey is VHPJRERTQYXLQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-5-14-16(19)18(8-9-20-4)15(17-14)13-10-11(2)6-7-12(13)3/h6-7,10,14-15,17H,5,8-9H2,1-4H3.
What are the key properties of 2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one?
2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one has a molecular weight of 292.45 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one is sourced from PubChem (CID 83257120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).