(2R)-2-ethyl-1-ethylsulfonylazetidine

C7H15NO2S — CID 174287718

IUPAC(2R)-2-ethyl-1-ethylsulfonylazetidine
SMILESCC[C@@H]1CCN1S(=O)(=O)CC
InChIInChI=1S/C7H15NO2S/c1-3-7-5-6-8(7)11(9,10)4-2/h7H,3-6H2,1-2H3/t7-/m1/s1
InChIKeyMIOZQYZTGZAYAJ-SSDOTTSWSA-N
MW177.27 g/mol
LogP0.82
Rot. Bonds3

About (2R)-2-ethyl-1-ethylsulfonylazetidine

(2R)-2-ethyl-1-ethylsulfonylazetidine (PubChem CID 174287718) has the molecular formula C7H15NO2S and a molecular weight of 177.27 g/mol. Its IUPAC name is (2R)-2-ethyl-1-ethylsulfonylazetidine.

Molecular Properties

Compound Name(2R)-2-ethyl-1-ethylsulfonylazetidine
PubChem CID174287718
Molecular FormulaC7H15NO2S
Molecular Weight177.27 g/mol
Exact Mass177.08
IUPAC Name(2R)-2-ethyl-1-ethylsulfonylazetidine
SMILESCC[C@@H]1CCN1S(=O)(=O)CC
InChIInChI=1S/C7H15NO2S/c1-3-7-5-6-8(7)11(9,10)4-2/h7H,3-6H2,1-2H3/t7-/m1/s1
InChIKeyMIOZQYZTGZAYAJ-SSDOTTSWSA-N
XLogP0.82
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.27
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (2R)-2-ethyl-1-ethylsulfonylazetidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethyl-1-ethylsulfonylazetidine?
The IUPAC name of (2R)-2-ethyl-1-ethylsulfonylazetidine (CID 174287718) is (2R)-2-ethyl-1-ethylsulfonylazetidine.
What is the SMILES notation for (2R)-2-ethyl-1-ethylsulfonylazetidine?
The canonical SMILES for (2R)-2-ethyl-1-ethylsulfonylazetidine is CC[C@@H]1CCN1S(=O)(=O)CC.
What is the InChIKey of (2R)-2-ethyl-1-ethylsulfonylazetidine?
The InChIKey is MIOZQYZTGZAYAJ-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H15NO2S/c1-3-7-5-6-8(7)11(9,10)4-2/h7H,3-6H2,1-2H3/t7-/m1/s1.
What are the key properties of (2R)-2-ethyl-1-ethylsulfonylazetidine?
(2R)-2-ethyl-1-ethylsulfonylazetidine has a molecular weight of 177.27 g/mol, XLogP of 0.82, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethyl-1-ethylsulfonylazetidine is sourced from PubChem (CID 174287718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).