5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one

C11H22N2O3S — CID 83255731

IUPAC5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one
SMILESCC(C)CC1NC(C)C(=O)N1CCS(C)(=O)=O
InChIInChI=1S/C11H22N2O3S/c1-8(2)7-10-12-9(3)11(14)13(10)5-6-17(4,15)16/h8-10,12H,5-7H2,1-4H3
InChIKeyJZJFBHPWEDRNIE-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.22
Rot. Bonds5

About 5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one

5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one (PubChem CID 83255731) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is 5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one
PubChem CID83255731
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC Name5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one
SMILESCC(C)CC1NC(C)C(=O)N1CCS(C)(=O)=O
InChIInChI=1S/C11H22N2O3S/c1-8(2)7-10-12-9(3)11(14)13(10)5-6-17(4,15)16/h8-10,12H,5-7H2,1-4H3
InChIKeyJZJFBHPWEDRNIE-UHFFFAOYSA-N
XLogP0.22
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83239439
3-(2-ethoxyethyl)-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83236846
3-hexyl-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83265031
5-methyl-2-(2-methylpropyl)-3-(2-propan-2-yloxyethyl)imidazolidin-4-one
CID 104767663
2-(2-methylpropyl)-3-(3-methylsulfonylpropyl)-5-propan-2-ylimidazolidin-4-one
CID 83245286
methyl 3-[4-methyl-2-(2-methylpropyl)-5-oxoimidazolidin-1-yl]propanoate
CID 83256808
5-(2-methylpropyl)-3-(2-methylsulfonylethyl)-2-propylimidazolidin-4-one
CID 83256860
5-ethyl-2-(2-methylpropyl)-3-(3-methylsulfonylpropyl)imidazolidin-4-one
CID 83244799
5-methyl-2-(2-methylpropyl)-3-(3-methylsulfinylpropyl)imidazolidin-4-one
CID 113488487
3-(2,3-dimethylbutyl)-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83258725
3-(2,2-dicyclopropylethyl)-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83258681
5-methyl-2-(2-methylpropyl)-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83249314

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one?
The IUPAC name of 5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one (CID 83255731) is 5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one.
What is the SMILES notation for 5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one?
The canonical SMILES for 5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one is CC(C)CC1NC(C)C(=O)N1CCS(C)(=O)=O.
What is the InChIKey of 5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one?
The InChIKey is JZJFBHPWEDRNIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-8(2)7-10-12-9(3)11(14)13(10)5-6-17(4,15)16/h8-10,12H,5-7H2,1-4H3.
What are the key properties of 5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one?
5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one has a molecular weight of 262.37 g/mol, XLogP of 0.22, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(2-methylpropyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one is sourced from PubChem (CID 83255731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).