1-thiophen-3-ylazetidine-3-sulfonamide

C7H10N2O2S2 — CID 175031536

IUPAC1-thiophen-3-ylazetidine-3-sulfonamide
SMILESNS(=O)(=O)C1CN(c2ccsc2)C1
InChIInChI=1S/C7H10N2O2S2/c8-13(10,11)7-3-9(4-7)6-1-2-12-5-6/h1-2,5,7H,3-4H2,(H2,8,10,11)
InChIKeyIEBNQGYKMBOYFP-UHFFFAOYSA-N
MW218.30 g/mol
LogP0.23
Rot. Bonds2

About 1-thiophen-3-ylazetidine-3-sulfonamide

1-thiophen-3-ylazetidine-3-sulfonamide (PubChem CID 175031536) has the molecular formula C7H10N2O2S2 and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-thiophen-3-ylazetidine-3-sulfonamide.

Molecular Properties

Compound Name1-thiophen-3-ylazetidine-3-sulfonamide
PubChem CID175031536
Molecular FormulaC7H10N2O2S2
Molecular Weight218.30 g/mol
Exact Mass218.02
IUPAC Name1-thiophen-3-ylazetidine-3-sulfonamide
SMILESNS(=O)(=O)C1CN(c2ccsc2)C1
InChIInChI=1S/C7H10N2O2S2/c8-13(10,11)7-3-9(4-7)6-1-2-12-5-6/h1-2,5,7H,3-4H2,(H2,8,10,11)
InChIKeyIEBNQGYKMBOYFP-UHFFFAOYSA-N
XLogP0.23
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-thiophen-3-ylazetidine-3-sulfonamide?
The IUPAC name of 1-thiophen-3-ylazetidine-3-sulfonamide (CID 175031536) is 1-thiophen-3-ylazetidine-3-sulfonamide.
What is the SMILES notation for 1-thiophen-3-ylazetidine-3-sulfonamide?
The canonical SMILES for 1-thiophen-3-ylazetidine-3-sulfonamide is NS(=O)(=O)C1CN(c2ccsc2)C1.
What is the InChIKey of 1-thiophen-3-ylazetidine-3-sulfonamide?
The InChIKey is IEBNQGYKMBOYFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2S2/c8-13(10,11)7-3-9(4-7)6-1-2-12-5-6/h1-2,5,7H,3-4H2,(H2,8,10,11).
What are the key properties of 1-thiophen-3-ylazetidine-3-sulfonamide?
1-thiophen-3-ylazetidine-3-sulfonamide has a molecular weight of 218.30 g/mol, XLogP of 0.23, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-thiophen-3-ylazetidine-3-sulfonamide is sourced from PubChem (CID 175031536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).