1-(2-fluoroethyl)azetidine-3-sulfonamide

C5H11FN2O2S — CID 137379999

IUPAC1-(2-fluoroethyl)azetidine-3-sulfonamide
SMILESNS(=O)(=O)C1CN(CCF)C1
InChIInChI=1S/C5H11FN2O2S/c6-1-2-8-3-5(4-8)11(7,9)10/h5H,1-4H2,(H2,7,9,10)
InChIKeyGANLZPKLCLHSKG-UHFFFAOYSA-N
MW182.22 g/mol
LogP-1.07
Rot. Bonds3

About 1-(2-fluoroethyl)azetidine-3-sulfonamide

1-(2-fluoroethyl)azetidine-3-sulfonamide (PubChem CID 137379999) has the molecular formula C5H11FN2O2S and a molecular weight of 182.22 g/mol. Its IUPAC name is 1-(2-fluoroethyl)azetidine-3-sulfonamide.

Molecular Properties

Compound Name1-(2-fluoroethyl)azetidine-3-sulfonamide
PubChem CID137379999
Molecular FormulaC5H11FN2O2S
Molecular Weight182.22 g/mol
Exact Mass182.05
IUPAC Name1-(2-fluoroethyl)azetidine-3-sulfonamide
SMILESNS(=O)(=O)C1CN(CCF)C1
InChIInChI=1S/C5H11FN2O2S/c6-1-2-8-3-5(4-8)11(7,9)10/h5H,1-4H2,(H2,7,9,10)
InChIKeyGANLZPKLCLHSKG-UHFFFAOYSA-N
XLogP-1.07
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 5-1.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoroethyl)azetidine-3-sulfonamide?
The IUPAC name of 1-(2-fluoroethyl)azetidine-3-sulfonamide (CID 137379999) is 1-(2-fluoroethyl)azetidine-3-sulfonamide.
What is the SMILES notation for 1-(2-fluoroethyl)azetidine-3-sulfonamide?
The canonical SMILES for 1-(2-fluoroethyl)azetidine-3-sulfonamide is NS(=O)(=O)C1CN(CCF)C1.
What is the InChIKey of 1-(2-fluoroethyl)azetidine-3-sulfonamide?
The InChIKey is GANLZPKLCLHSKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11FN2O2S/c6-1-2-8-3-5(4-8)11(7,9)10/h5H,1-4H2,(H2,7,9,10).
What are the key properties of 1-(2-fluoroethyl)azetidine-3-sulfonamide?
1-(2-fluoroethyl)azetidine-3-sulfonamide has a molecular weight of 182.22 g/mol, XLogP of -1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)azetidine-3-sulfonamide is sourced from PubChem (CID 137379999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).