5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one

C14H20N2OS — CID 83256953

IUPAC5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one
SMILESCCC1NC(c2ccccc2)N(CCSC)C1=O
InChIInChI=1S/C14H20N2OS/c1-3-12-14(17)16(9-10-18-2)13(15-12)11-7-5-4-6-8-11/h4-8,12-13,15H,3,9-10H2,1-2H3
InChIKeyVBGDRBSOZBIKNY-UHFFFAOYSA-N
MW264.39 g/mol
LogP2.26
Rot. Bonds5

About 5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one

5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one (PubChem CID 83256953) has the molecular formula C14H20N2OS and a molecular weight of 264.39 g/mol. Its IUPAC name is 5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one
PubChem CID83256953
Molecular FormulaC14H20N2OS
Molecular Weight264.39 g/mol
Exact Mass264.13
IUPAC Name5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one
SMILESCCC1NC(c2ccccc2)N(CCSC)C1=O
InChIInChI=1S/C14H20N2OS/c1-3-12-14(17)16(9-10-18-2)13(15-12)11-7-5-4-6-8-11/h4-8,12-13,15H,3,9-10H2,1-2H3
InChIKeyVBGDRBSOZBIKNY-UHFFFAOYSA-N
XLogP2.26
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-butyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one
CID 83258190
5-ethyl-2-(4-methylsulfanylphenyl)-3-(3-methylsulfanylpropyl)imidazolidin-4-one
CID 83264326
2-(4-fluorophenyl)-3-(2-methylsulfanylethyl)-5-propylimidazolidin-4-one
CID 83257869
methyl 3-(4-ethyl-5-oxo-2-phenylimidazolidin-1-yl)propanoate
CID 83256152
2-(2,5-dimethylphenyl)-5-ethyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83257120
2-(3-methoxyphenyl)-3-(2-methylsulfanylethyl)-5-propylimidazolidin-4-one
CID 83263494
3,5-dibutyl-2-phenylimidazolidin-4-one
CID 83237789
5-ethyl-2-(2-methoxyphenyl)-3-(3-methylsulfanylpropyl)imidazolidin-4-one
CID 83264187
3-(2-methyl-3-methylsulfanylpropyl)-2-phenyl-5-propylimidazolidin-4-one
CID 83263712
5-ethyl-2-(4-methoxyphenyl)-3-propylimidazolidin-4-one
CID 83242345
2-(2,4-dimethylphenyl)-5-ethyl-3-(3-methylsulfanylpropyl)imidazolidin-4-one
CID 83264334
2-(3-fluorophenyl)-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83257620

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one?
The IUPAC name of 5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one (CID 83256953) is 5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one is CCC1NC(c2ccccc2)N(CCSC)C1=O.
What is the InChIKey of 5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one?
The InChIKey is VBGDRBSOZBIKNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2OS/c1-3-12-14(17)16(9-10-18-2)13(15-12)11-7-5-4-6-8-11/h4-8,12-13,15H,3,9-10H2,1-2H3.
What are the key properties of 5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one?
5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one has a molecular weight of 264.39 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one is sourced from PubChem (CID 83256953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).