4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide

C10H14N6O2S — CID 113412993

IUPAC4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide
SMILESNNc1ccc(S(=O)(=O)NCCn2ccnn2)cc1
InChIInChI=1S/C10H14N6O2S/c11-14-9-1-3-10(4-2-9)19(17,18)13-6-8-16-7-5-12-15-16/h1-5,7,13-14H,6,8,11H2
InChIKeyHZAKTQQFHWKDBM-UHFFFAOYSA-N
MW282.33 g/mol
LogP-0.46
Rot. Bonds6

About 4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide

4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide (PubChem CID 113412993) has the molecular formula C10H14N6O2S and a molecular weight of 282.33 g/mol. Its IUPAC name is 4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide
PubChem CID113412993
Molecular FormulaC10H14N6O2S
Molecular Weight282.33 g/mol
Exact Mass282.09
IUPAC Name4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide
SMILESNNc1ccc(S(=O)(=O)NCCn2ccnn2)cc1
InChIInChI=1S/C10H14N6O2S/c11-14-9-1-3-10(4-2-9)19(17,18)13-6-8-16-7-5-12-15-16/h1-5,7,13-14H,6,8,11H2
InChIKeyHZAKTQQFHWKDBM-UHFFFAOYSA-N
XLogP-0.46
TPSA114.93 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.33
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-hydrazinyl-N-(3-imidazol-1-ylpropyl)benzenesulfonamide
CID 43455140
5-(aminomethyl)-N-[2-(triazol-1-yl)ethyl]thiophene-3-sulfonamide
CID 106077153
2-chloro-4-[2-(triazol-1-yl)ethylsulfamoyl]benzoic acid
CID 107090248
N-[2-(triazol-1-yl)ethyl]-1H-pyrazole-5-sulfonamide
CID 102693334
4-amino-N-[2-(triazol-1-yl)ethyl]pyridine-3-sulfonamide
CID 113413216
5-(hydroxymethyl)-N-[2-(triazol-1-yl)ethyl]thiophene-3-sulfonamide
CID 114135368
4-hydrazinyl-N-(2-thiomorpholin-4-ylethyl)benzenesulfonamide
CID 106325962
4-hydrazinyl-N-[2-(methanesulfonamido)ethyl]benzenesulfonamide
CID 43546298
2-(aminomethyl)-5-fluoro-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide
CID 106077186
4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide
CID 43454992
4-bromo-2-chloro-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide
CID 113375159
5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide
CID 104643051

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide?
The IUPAC name of 4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide (CID 113412993) is 4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide.
What is the SMILES notation for 4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide?
The canonical SMILES for 4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide is NNc1ccc(S(=O)(=O)NCCn2ccnn2)cc1.
What is the InChIKey of 4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide?
The InChIKey is HZAKTQQFHWKDBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O2S/c11-14-9-1-3-10(4-2-9)19(17,18)13-6-8-16-7-5-12-15-16/h1-5,7,13-14H,6,8,11H2.
What are the key properties of 4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide?
4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide has a molecular weight of 282.33 g/mol, XLogP of -0.46, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-[2-(triazol-1-yl)ethyl]benzenesulfonamide is sourced from PubChem (CID 113412993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).