3-fluoroazetidine-1-sulfonamide

C3H7FN2O2S — CID 70347983

IUPAC3-fluoroazetidine-1-sulfonamide
SMILESNS(=O)(=O)N1CC(F)C1
InChIInChI=1S/C3H7FN2O2S/c4-3-1-6(2-3)9(5,7)8/h3H,1-2H2,(H2,5,7,8)
InChIKeyNZTQSMWAAADWTA-UHFFFAOYSA-N
MW154.17 g/mol
LogP-1.16
Rot. Bonds1

About 3-fluoroazetidine-1-sulfonamide

3-fluoroazetidine-1-sulfonamide (PubChem CID 70347983) has the molecular formula C3H7FN2O2S and a molecular weight of 154.17 g/mol. Its IUPAC name is 3-fluoroazetidine-1-sulfonamide.

Molecular Properties

Compound Name3-fluoroazetidine-1-sulfonamide
PubChem CID70347983
Molecular FormulaC3H7FN2O2S
Molecular Weight154.17 g/mol
Exact Mass154.02
IUPAC Name3-fluoroazetidine-1-sulfonamide
SMILESNS(=O)(=O)N1CC(F)C1
InChIInChI=1S/C3H7FN2O2S/c4-3-1-6(2-3)9(5,7)8/h3H,1-2H2,(H2,5,7,8)
InChIKeyNZTQSMWAAADWTA-UHFFFAOYSA-N
XLogP-1.16
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-1.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoroazetidine-1-sulfonamide?
The IUPAC name of 3-fluoroazetidine-1-sulfonamide (CID 70347983) is 3-fluoroazetidine-1-sulfonamide.
What is the SMILES notation for 3-fluoroazetidine-1-sulfonamide?
The canonical SMILES for 3-fluoroazetidine-1-sulfonamide is NS(=O)(=O)N1CC(F)C1.
What is the InChIKey of 3-fluoroazetidine-1-sulfonamide?
The InChIKey is NZTQSMWAAADWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7FN2O2S/c4-3-1-6(2-3)9(5,7)8/h3H,1-2H2,(H2,5,7,8).
What are the key properties of 3-fluoroazetidine-1-sulfonamide?
3-fluoroazetidine-1-sulfonamide has a molecular weight of 154.17 g/mol, XLogP of -1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoroazetidine-1-sulfonamide is sourced from PubChem (CID 70347983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).