1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine

C9H18N2O3S — CID 165492667

IUPAC1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine
SMILESO=S(=O)(CCOC1CNC1)N1CCCC1
InChIInChI=1S/C9H18N2O3S/c12-15(13,11-3-1-2-4-11)6-5-14-9-7-10-8-9/h9-10H,1-8H2
InChIKeyMGUVUZKLFGFRJA-UHFFFAOYSA-N
MW234.32 g/mol
LogP-0.60
Rot. Bonds5

About 1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine

1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine (PubChem CID 165492667) has the molecular formula C9H18N2O3S and a molecular weight of 234.32 g/mol. Its IUPAC name is 1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine.

Molecular Properties

Compound Name1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine
PubChem CID165492667
Molecular FormulaC9H18N2O3S
Molecular Weight234.32 g/mol
Exact Mass234.10
IUPAC Name1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine
SMILESO=S(=O)(CCOC1CNC1)N1CCCC1
InChIInChI=1S/C9H18N2O3S/c12-15(13,11-3-1-2-4-11)6-5-14-9-7-10-8-9/h9-10H,1-8H2
InChIKeyMGUVUZKLFGFRJA-UHFFFAOYSA-N
XLogP-0.60
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine 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 1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine?
The IUPAC name of 1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine (CID 165492667) is 1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine.
What is the SMILES notation for 1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine?
The canonical SMILES for 1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine is O=S(=O)(CCOC1CNC1)N1CCCC1.
What is the InChIKey of 1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine?
The InChIKey is MGUVUZKLFGFRJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3S/c12-15(13,11-3-1-2-4-11)6-5-14-9-7-10-8-9/h9-10H,1-8H2.
What are the key properties of 1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine?
1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine has a molecular weight of 234.32 g/mol, XLogP of -0.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(azetidin-3-yloxy)ethylsulfonyl]pyrrolidine is sourced from PubChem (CID 165492667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).