azetidine-1-sulfonamide

C3H8N2O2S — CID 45080566

IUPACazetidine-1-sulfonamide
SMILESNS(=O)(=O)N1CCC1
InChIInChI=1S/C3H8N2O2S/c4-8(6,7)5-2-1-3-5/h1-3H2,(H2,4,6,7)
InChIKeySTIUWSWFXIBBKI-UHFFFAOYSA-N
MW136.18 g/mol
LogP-1.10
Rot. Bonds1

About azetidine-1-sulfonamide

azetidine-1-sulfonamide (PubChem CID 45080566) has the molecular formula C3H8N2O2S and a molecular weight of 136.18 g/mol. Its IUPAC name is azetidine-1-sulfonamide.

Molecular Properties

Compound Nameazetidine-1-sulfonamide
PubChem CID45080566
Molecular FormulaC3H8N2O2S
Molecular Weight136.18 g/mol
Exact Mass136.03
IUPAC Nameazetidine-1-sulfonamide
SMILESNS(=O)(=O)N1CCC1
InChIInChI=1S/C3H8N2O2S/c4-8(6,7)5-2-1-3-5/h1-3H2,(H2,4,6,7)
InChIKeySTIUWSWFXIBBKI-UHFFFAOYSA-N
XLogP-1.10
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.18
LogP ≤ 5-1.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of azetidine-1-sulfonamide?
The IUPAC name of azetidine-1-sulfonamide (CID 45080566) is azetidine-1-sulfonamide.
What is the SMILES notation for azetidine-1-sulfonamide?
The canonical SMILES for azetidine-1-sulfonamide is NS(=O)(=O)N1CCC1.
What is the InChIKey of azetidine-1-sulfonamide?
The InChIKey is STIUWSWFXIBBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N2O2S/c4-8(6,7)5-2-1-3-5/h1-3H2,(H2,4,6,7).
What are the key properties of azetidine-1-sulfonamide?
azetidine-1-sulfonamide has a molecular weight of 136.18 g/mol, XLogP of -1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azetidine-1-sulfonamide is sourced from PubChem (CID 45080566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).