triazole-1-sulfonamide

C2H4N4O2S — CID 22401447

IUPACtriazole-1-sulfonamide
SMILESNS(=O)(=O)n1ccnn1
InChIInChI=1S/C2H4N4O2S/c3-9(7,8)6-2-1-4-5-6/h1-2H,(H2,3,7,8)
InChIKeyYWGZBLRRLREJIR-UHFFFAOYSA-N
MW148.15 g/mol
LogP-1.67
Rot. Bonds1

About triazole-1-sulfonamide

triazole-1-sulfonamide (PubChem CID 22401447) has the molecular formula C2H4N4O2S and a molecular weight of 148.15 g/mol. Its IUPAC name is triazole-1-sulfonamide.

Molecular Properties

Compound Nametriazole-1-sulfonamide
PubChem CID22401447
Molecular FormulaC2H4N4O2S
Molecular Weight148.15 g/mol
Exact Mass148.01
IUPAC Nametriazole-1-sulfonamide
SMILESNS(=O)(=O)n1ccnn1
InChIInChI=1S/C2H4N4O2S/c3-9(7,8)6-2-1-4-5-6/h1-2H,(H2,3,7,8)
InChIKeyYWGZBLRRLREJIR-UHFFFAOYSA-N
XLogP-1.67
TPSA90.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.15
LogP ≤ 5-1.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-propan-2-ylsulfonyltriazole
CID 175856255
1-[2,4,6-tri(propan-2-yl)phenyl]sulfonyltriazole
CID 19818805
silver 1-sulfanyltriazole
CID 22237742
2-[3-(triazol-1-yl)propylamino]ethanesulfonamide
CID 114385172
1-[2-(sulfamoylamino)phenyl]triazole
CID 112573317
2-(triazol-1-yl)ethanesulfonyl chloride
CID 130116342
triazol-1-ylhydrazine
CID 154372556
(2E,4E)-5-(methylideneamino)-5-(triazol-1-yl)penta-2,4-diene-2-sulfonamide
CID 146529797
triazol-1-ylarsane
CID 173369083
CID 143951776
CID 143951776
carboxy(triazol-1-yl)carbamic acid
CID 67445650
carbamoyl triazole-1-carboxylate
CID 140664884

Frequently Asked Questions

What is the IUPAC name of triazole-1-sulfonamide?
The IUPAC name of triazole-1-sulfonamide (CID 22401447) is triazole-1-sulfonamide.
What is the SMILES notation for triazole-1-sulfonamide?
The canonical SMILES for triazole-1-sulfonamide is NS(=O)(=O)n1ccnn1.
What is the InChIKey of triazole-1-sulfonamide?
The InChIKey is YWGZBLRRLREJIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4N4O2S/c3-9(7,8)6-2-1-4-5-6/h1-2H,(H2,3,7,8).
What are the key properties of triazole-1-sulfonamide?
triazole-1-sulfonamide has a molecular weight of 148.15 g/mol, XLogP of -1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triazole-1-sulfonamide is sourced from PubChem (CID 22401447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).