N-(thiadiazol-4-ylmethyl)methanesulfonamide

C4H7N3O2S2 — CID 130901499

IUPACN-(thiadiazol-4-ylmethyl)methanesulfonamide
SMILESCS(=O)(=O)NCc1csnn1
InChIInChI=1S/C4H7N3O2S2/c1-11(8,9)5-2-4-3-10-7-6-4/h3,5H,2H2,1H3
InChIKeyZPOTYHUVSXHPOH-UHFFFAOYSA-N
MW193.25 g/mol
LogP-0.41
Rot. Bonds3

About N-(thiadiazol-4-ylmethyl)methanesulfonamide

N-(thiadiazol-4-ylmethyl)methanesulfonamide (PubChem CID 130901499) has the molecular formula C4H7N3O2S2 and a molecular weight of 193.25 g/mol. Its IUPAC name is N-(thiadiazol-4-ylmethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(thiadiazol-4-ylmethyl)methanesulfonamide
PubChem CID130901499
Molecular FormulaC4H7N3O2S2
Molecular Weight193.25 g/mol
Exact Mass193.00
IUPAC NameN-(thiadiazol-4-ylmethyl)methanesulfonamide
SMILESCS(=O)(=O)NCc1csnn1
InChIInChI=1S/C4H7N3O2S2/c1-11(8,9)5-2-4-3-10-7-6-4/h3,5H,2H2,1H3
InChIKeyZPOTYHUVSXHPOH-UHFFFAOYSA-N
XLogP-0.41
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 5-0.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(thiadiazol-4-ylmethyl)methanesulfonamide?
The IUPAC name of N-(thiadiazol-4-ylmethyl)methanesulfonamide (CID 130901499) is N-(thiadiazol-4-ylmethyl)methanesulfonamide.
What is the SMILES notation for N-(thiadiazol-4-ylmethyl)methanesulfonamide?
The canonical SMILES for N-(thiadiazol-4-ylmethyl)methanesulfonamide is CS(=O)(=O)NCc1csnn1.
What is the InChIKey of N-(thiadiazol-4-ylmethyl)methanesulfonamide?
The InChIKey is ZPOTYHUVSXHPOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3O2S2/c1-11(8,9)5-2-4-3-10-7-6-4/h3,5H,2H2,1H3.
What are the key properties of N-(thiadiazol-4-ylmethyl)methanesulfonamide?
N-(thiadiazol-4-ylmethyl)methanesulfonamide has a molecular weight of 193.25 g/mol, XLogP of -0.41, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiadiazol-4-ylmethyl)methanesulfonamide is sourced from PubChem (CID 130901499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).