5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one

C16H24N2OS — CID 83258033

IUPAC5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one
SMILESCSCCN1C(=O)C(Cc2ccccc2)NC1C(C)C
InChIInChI=1S/C16H24N2OS/c1-12(2)15-17-14(11-13-7-5-4-6-8-13)16(19)18(15)9-10-20-3/h4-8,12,14-15,17H,9-11H2,1-3H3
InChIKeyQAEASFAIIMYHIX-UHFFFAOYSA-N
MW292.45 g/mol
LogP2.37
Rot. Bonds6

About 5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one

5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one (PubChem CID 83258033) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is 5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one
PubChem CID83258033
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC Name5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one
SMILESCSCCN1C(=O)C(Cc2ccccc2)NC1C(C)C
InChIInChI=1S/C16H24N2OS/c1-12(2)15-17-14(11-13-7-5-4-6-8-13)16(19)18(15)9-10-20-3/h4-8,12,14-15,17H,9-11H2,1-3H3
InChIKeyQAEASFAIIMYHIX-UHFFFAOYSA-N
XLogP2.37
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-benzyl-3-butan-2-yl-2-propan-2-ylimidazolidin-4-one
CID 83239760
5-benzyl-3-(2,2-dimethylcyclopropyl)-2-propan-2-ylimidazolidin-4-one
CID 83247652
5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one
CID 83243023
5-ethyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one
CID 83256953
5-benzyl-3-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83242743
5-benzyl-3-(2,2-difluoroethyl)-2-methylimidazolidin-4-one
CID 83270412
5-butan-2-yl-3-(3-methylsulfanylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 83257737
5-butyl-3-(2-methylsulfanylethyl)-2-phenylimidazolidin-4-one
CID 83258190
5-benzyl-3-hexyl-2-methylimidazolidin-4-one
CID 83263610
2-methyl-5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83257702
(2S,5S)-5-benzyl-3-methyl-2-(1-phenylethenyl)imidazolidin-4-one
CID 46192062
(2S,5S)-5-benzyl-2-tert-butyl-3-(hydroxymethyl)imidazolidin-4-one
CID 69326058

Frequently Asked Questions

What is the IUPAC name of 5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one?
The IUPAC name of 5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one (CID 83258033) is 5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one is CSCCN1C(=O)C(Cc2ccccc2)NC1C(C)C.
What is the InChIKey of 5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one?
The InChIKey is QAEASFAIIMYHIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-12(2)15-17-14(11-13-7-5-4-6-8-13)16(19)18(15)9-10-20-3/h4-8,12,14-15,17H,9-11H2,1-3H3.
What are the key properties of 5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one?
5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one has a molecular weight of 292.45 g/mol, XLogP of 2.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-3-(2-methylsulfanylethyl)-2-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 83258033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).