2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one

C16H24N2OS — CID 114929249

IUPAC2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one
SMILESCSCC(C)N1C(=O)C(CCc2ccccc2)NC1C
InChIInChI=1S/C16H24N2OS/c1-12(11-20-3)18-13(2)17-15(16(18)19)10-9-14-7-5-4-6-8-14/h4-8,12-13,15,17H,9-11H2,1-3H3
InChIKeyJAXJHYQPLYSUSQ-UHFFFAOYSA-N
MW292.45 g/mol
LogP2.52
Rot. Bonds6

About 2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one

2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one (PubChem CID 114929249) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is 2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one
PubChem CID114929249
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC Name2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one
SMILESCSCC(C)N1C(=O)C(CCc2ccccc2)NC1C
InChIInChI=1S/C16H24N2OS/c1-12(11-20-3)18-13(2)17-15(16(18)19)10-9-14-7-5-4-6-8-14/h4-8,12-13,15,17H,9-11H2,1-3H3
InChIKeyJAXJHYQPLYSUSQ-UHFFFAOYSA-N
XLogP2.52
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 ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one
CID 114921482
3-(2-cyclopropylpropyl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one
CID 114929268
2-methyl-5-(2-phenylethyl)-3-(2-propan-2-yloxyethyl)imidazolidin-4-one
CID 114928963
5-benzyl-3-hexan-2-yl-2-methylimidazolidin-4-one
CID 83253722
3-hexyl-2-methyl-5-(2-phenylethyl)imidazolidin-4-one
CID 114926561
2-ethyl-3-(2-methylpropyl)-5-(2-phenylethyl)imidazolidin-4-one
CID 114921798
2-ethyl-3-(3-methylbutyl)-5-(2-phenylethyl)imidazolidin-4-one
CID 114921334
5-benzyl-3-(dicyclopropylmethyl)-2-methylimidazolidin-4-one
CID 83252653
5-butyl-2-methyl-3-pentan-2-ylimidazolidin-4-one
CID 83239016
2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one
CID 114921936
3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one
CID 83240070
2-methyl-3-(6-methylheptan-2-yl)-5-propylimidazolidin-4-one
CID 83252812

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one?
The IUPAC name of 2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one (CID 114929249) is 2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one.
What is the SMILES notation for 2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one?
The canonical SMILES for 2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one is CSCC(C)N1C(=O)C(CCc2ccccc2)NC1C.
What is the InChIKey of 2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one?
The InChIKey is JAXJHYQPLYSUSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-12(11-20-3)18-13(2)17-15(16(18)19)10-9-14-7-5-4-6-8-14/h4-8,12-13,15,17H,9-11H2,1-3H3.
What are the key properties of 2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one?
2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one has a molecular weight of 292.45 g/mol, XLogP of 2.52, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one is sourced from PubChem (CID 114929249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).