ethylsulfonylcyclopentane

C7H14O2S — CID 66796207

IUPACethylsulfonylcyclopentane
SMILESCCS(=O)(=O)C1CCCC1
InChIInChI=1S/C7H14O2S/c1-2-10(8,9)7-5-3-4-6-7/h7H,2-6H2,1H3
InChIKeyARZBHCRIGOZTDT-UHFFFAOYSA-N
MW162.25 g/mol
LogP1.36
Rot. Bonds2

About ethylsulfonylcyclopentane

ethylsulfonylcyclopentane (PubChem CID 66796207) has the molecular formula C7H14O2S and a molecular weight of 162.25 g/mol. Its IUPAC name is ethylsulfonylcyclopentane.

Molecular Properties

Compound Nameethylsulfonylcyclopentane
PubChem CID66796207
Molecular FormulaC7H14O2S
Molecular Weight162.25 g/mol
Exact Mass162.07
IUPAC Nameethylsulfonylcyclopentane
SMILESCCS(=O)(=O)C1CCCC1
InChIInChI=1S/C7H14O2S/c1-2-10(8,9)7-5-3-4-6-7/h7H,2-6H2,1H3
InChIKeyARZBHCRIGOZTDT-UHFFFAOYSA-N
XLogP1.36
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.25
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethylsulfonylcyclopentane?
The IUPAC name of ethylsulfonylcyclopentane (CID 66796207) is ethylsulfonylcyclopentane.
What is the SMILES notation for ethylsulfonylcyclopentane?
The canonical SMILES for ethylsulfonylcyclopentane is CCS(=O)(=O)C1CCCC1.
What is the InChIKey of ethylsulfonylcyclopentane?
The InChIKey is ARZBHCRIGOZTDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O2S/c1-2-10(8,9)7-5-3-4-6-7/h7H,2-6H2,1H3.
What are the key properties of ethylsulfonylcyclopentane?
ethylsulfonylcyclopentane has a molecular weight of 162.25 g/mol, XLogP of 1.36, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethylsulfonylcyclopentane is sourced from PubChem (CID 66796207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).