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

C12H22N2O3S — CID 83262831

IUPAC2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one
SMILESCC(CS(C)(=O)=O)N1C(=O)CNC1C1CCCC1
InChIInChI=1S/C12H22N2O3S/c1-9(8-18(2,16)17)14-11(15)7-13-12(14)10-5-3-4-6-10/h9-10,12-13H,3-8H2,1-2H3
InChIKeyAFMPEZNXTDTFMZ-UHFFFAOYSA-N
MW274.39 g/mol
LogP0.37
Rot. Bonds4

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

2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one (PubChem CID 83262831) has the molecular formula C12H22N2O3S and a molecular weight of 274.39 g/mol. Its IUPAC name is 2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one.

Molecular Properties

Compound Name2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one
PubChem CID83262831
Molecular FormulaC12H22N2O3S
Molecular Weight274.39 g/mol
Exact Mass274.14
IUPAC Name2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one
SMILESCC(CS(C)(=O)=O)N1C(=O)CNC1C1CCCC1
InChIInChI=1S/C12H22N2O3S/c1-9(8-18(2,16)17)14-11(15)7-13-12(14)10-5-3-4-6-10/h9-10,12-13H,3-8H2,1-2H3
InChIKeyAFMPEZNXTDTFMZ-UHFFFAOYSA-N
XLogP0.37
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopentyl-3-(1-methoxypropan-2-yl)imidazolidin-4-one
CID 83238893
2-(2-methylpropyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one
CID 83263628
6-methyl-1-(1-methylsulfonylpropan-2-yl)piperazine-2,5-dione
CID 64973062
2-(4-methoxyphenyl)-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one
CID 83262833
2-cyclopentyl-3-[1-(dimethylamino)-4-methylpentan-2-yl]imidazolidin-4-one
CID 83247154
3-cyclohexyl-1-(1-methylsulfonylpropan-2-yl)piperazine
CID 64954449
2-methyl-3-(1-methylsulfonylpropan-2-yl)-1,3-diazaspiro[4.4]nonan-4-one
CID 83262988
2-cyclopentyl-3-octylimidazolidin-4-one
CID 83260832
2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one
CID 106011110
2-cyclopentyl-3-(3,5-dimethylcyclohexyl)imidazolidin-4-one
CID 83259228
2-cyclopentyl-3-(2-fluoroethyl)imidazolidin-4-one
CID 130504754
3,3-diethyl-6-methyl-1-(1-methylsulfonylpropan-2-yl)piperazine-2,5-dione
CID 64973042

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one?
The IUPAC name of 2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one (CID 83262831) is 2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one.
What is the SMILES notation for 2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one?
The canonical SMILES for 2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one is CC(CS(C)(=O)=O)N1C(=O)CNC1C1CCCC1.
What is the InChIKey of 2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one?
The InChIKey is AFMPEZNXTDTFMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3S/c1-9(8-18(2,16)17)14-11(15)7-13-12(14)10-5-3-4-6-10/h9-10,12-13H,3-8H2,1-2H3.
What are the key properties of 2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one?
2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one has a molecular weight of 274.39 g/mol, XLogP of 0.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-3-(1-methylsulfonylpropan-2-yl)imidazolidin-4-one is sourced from PubChem (CID 83262831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).