2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one

C11H22N2O3S — CID 83263628

IUPAC2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one
SMILESCC(C)CC1NCC(=O)N1C(C)CS(C)(=O)=O
InChIInChI=1S/C11H22N2O3S/c1-8(2)5-10-12-6-11(14)13(10)9(3)7-17(4,15)16/h8-10,12H,5-7H2,1-4H3
InChIKeyVVBXUSBICIZGST-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.22
Rot. Bonds5

About 2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one

2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one (PubChem CID 83263628) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is 2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one.

Molecular Properties

Compound Name2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one
PubChem CID83263628
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC Name2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one
SMILESCC(C)CC1NCC(=O)N1C(C)CS(C)(=O)=O
InChIInChI=1S/C11H22N2O3S/c1-8(2)5-10-12-6-11(14)13(10)9(3)7-17(4,15)16/h8-10,12H,5-7H2,1-4H3
InChIKeyVVBXUSBICIZGST-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

2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one
CID 83262831
3-heptan-2-yl-2-(2-methylpropyl)imidazolidin-4-one
CID 83253857
3-(dicyclopropylmethyl)-2-(2-methylpropyl)imidazolidin-4-one
CID 83253006
6-methyl-1-(1-methylsulfonylpropan-2-yl)piperazine-2,5-dione
CID 64973062
5-ethyl-2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one
CID 83264729
2-(4-methoxyphenyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one
CID 83262833
2-(2-methylpropyl)-3-octan-4-ylimidazolidin-4-one
CID 106021540
3-[4-[methyl(propan-2-yl)amino]butyl]-2-(2-methylpropyl)imidazolidin-4-one
CID 83247971
3-[2-(dimethylamino)ethyl]-2-(2-methylpropyl)imidazolidin-4-one
CID 83250663
2-methyl-3-(1-methylsulfonylpropan-2-yl)-1,3-diazaspiro[4.4]nonan-4-one
CID 83262988
3-(2-methylpropyl)-1-(1-methylsulfonylpropan-2-yl)-1,4-diazepane-2,5-dione
CID 64972970
3-(2-methylcycloheptyl)-2-(2-methylpropyl)imidazolidin-4-one
CID 83258606

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one?
The IUPAC name of 2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one (CID 83263628) is 2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one.
What is the SMILES notation for 2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one?
The canonical SMILES for 2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one is CC(C)CC1NCC(=O)N1C(C)CS(C)(=O)=O.
What is the InChIKey of 2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one?
The InChIKey is VVBXUSBICIZGST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-8(2)5-10-12-6-11(14)13(10)9(3)7-17(4,15)16/h8-10,12H,5-7H2,1-4H3.
What are the key properties of 2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one?
2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)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 2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one is sourced from PubChem (CID 83263628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).