hydron;2H-triazole-4-sulfonamide

C2H5N4O2S+ — CID 174871340

IUPAChydron;2H-triazole-4-sulfonamide
SMILESNS(=O)(=O)c1cn[nH]n1.[H+]
InChIInChI=1S/C2H4N4O2S/c3-9(7,8)2-1-4-6-5-2/h1H,(H2,3,7,8)(H,4,5,6)/p+1
InChIKeyWAIIVJKIXMLKTR-UHFFFAOYSA-O
MW149.16 g/mol
LogP-1.44
Rot. Bonds1

About hydron;2H-triazole-4-sulfonamide

hydron;2H-triazole-4-sulfonamide (PubChem CID 174871340) has the molecular formula C2H5N4O2S+ and a molecular weight of 149.16 g/mol. Its IUPAC name is hydron;2H-triazole-4-sulfonamide.

Molecular Properties

Compound Namehydron;2H-triazole-4-sulfonamide
PubChem CID174871340
Molecular FormulaC2H5N4O2S+
Molecular Weight149.16 g/mol
Exact Mass149.01
IUPAC Namehydron;2H-triazole-4-sulfonamide
SMILESNS(=O)(=O)c1cn[nH]n1.[H+]
InChIInChI=1S/C2H4N4O2S/c3-9(7,8)2-1-4-6-5-2/h1H,(H2,3,7,8)(H,4,5,6)/p+1
InChIKeyWAIIVJKIXMLKTR-UHFFFAOYSA-O
XLogP-1.44
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.16
LogP ≤ 5-1.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethylsulfonyl-2H-triazole
CID 12894702
1-(2H-triazol-4-ylsulfonyl)piperazine
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CID 75386582
4-(methylsulfonylmethyl)-2H-triazole
CID 125453758
N-phenyl-2H-triazole-4-sulfonamide;pyrimidine
CID 174514310
4-amino-2H-triazine-5-thione
CID 68762394
1,2,5-thiadiazole-3-sulfonamide
CID 57318095
azanium 2H-triazol-4-yl sulfate
CID 141437240
3-(4-bromo-2-chlorophenyl)-1-(2H-triazol-4-ylsulfonyl)azetidin-3-ol
CID 154855349
N-(4-methyl-3-sulfamoylphenyl)-2H-triazole-4-carboxamide
CID 47367376
N-[1-(4-sulfamoylphenyl)ethyl]-2H-triazole-4-carboxamide
CID 112732641
[4-(2H-triazol-4-ylsulfonyl)piperazin-1-yl] 2,2-dimethylpropanoate
CID 175278595

Frequently Asked Questions

What is the IUPAC name of hydron;2H-triazole-4-sulfonamide?
The IUPAC name of hydron;2H-triazole-4-sulfonamide (CID 174871340) is hydron;2H-triazole-4-sulfonamide.
What is the SMILES notation for hydron;2H-triazole-4-sulfonamide?
The canonical SMILES for hydron;2H-triazole-4-sulfonamide is NS(=O)(=O)c1cn[nH]n1.[H+].
What is the InChIKey of hydron;2H-triazole-4-sulfonamide?
The InChIKey is WAIIVJKIXMLKTR-UHFFFAOYSA-O. The full InChI is InChI=1S/C2H4N4O2S/c3-9(7,8)2-1-4-6-5-2/h1H,(H2,3,7,8)(H,4,5,6)/p+1.
What are the key properties of hydron;2H-triazole-4-sulfonamide?
hydron;2H-triazole-4-sulfonamide has a molecular weight of 149.16 g/mol, XLogP of -1.44, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;2H-triazole-4-sulfonamide is sourced from PubChem (CID 174871340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).