4-hydrazinylbenzenesulfonamide;hydrochloride

C6H10ClN3O2S — CID 2794567

IUPAC4-hydrazinylbenzenesulfonamide;hydrochloride
SMILESCl.NNc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C6H9N3O2S.ClH/c7-9-5-1-3-6(4-2-5)12(8,10)11;/h1-4,9H,7H2,(H2,8,10,11);1H
InChIKeyIKEURONJLPUALY-UHFFFAOYSA-N
MW223.69 g/mol
LogP0.04
Rot. Bonds2

About 4-hydrazinylbenzenesulfonamide;hydrochloride

4-hydrazinylbenzenesulfonamide;hydrochloride (PubChem CID 2794567) has the molecular formula C6H10ClN3O2S and a molecular weight of 223.69 g/mol. Its IUPAC name is 4-hydrazinylbenzenesulfonamide;hydrochloride.

Molecular Properties

Compound Name4-hydrazinylbenzenesulfonamide;hydrochloride
PubChem CID2794567
Molecular FormulaC6H10ClN3O2S
Molecular Weight223.69 g/mol
Exact Mass223.02
IUPAC Name4-hydrazinylbenzenesulfonamide;hydrochloride
SMILESCl.NNc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C6H9N3O2S.ClH/c7-9-5-1-3-6(4-2-5)12(8,10)11;/h1-4,9H,7H2,(H2,8,10,11);1H
InChIKeyIKEURONJLPUALY-UHFFFAOYSA-N
XLogP0.04
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.69
LogP ≤ 50.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-hydrazinylbenzenesulfonamide;hydrochloride?
The IUPAC name of 4-hydrazinylbenzenesulfonamide;hydrochloride (CID 2794567) is 4-hydrazinylbenzenesulfonamide;hydrochloride.
What is the SMILES notation for 4-hydrazinylbenzenesulfonamide;hydrochloride?
The canonical SMILES for 4-hydrazinylbenzenesulfonamide;hydrochloride is Cl.NNc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 4-hydrazinylbenzenesulfonamide;hydrochloride?
The InChIKey is IKEURONJLPUALY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2S.ClH/c7-9-5-1-3-6(4-2-5)12(8,10)11;/h1-4,9H,7H2,(H2,8,10,11);1H.
What are the key properties of 4-hydrazinylbenzenesulfonamide;hydrochloride?
4-hydrazinylbenzenesulfonamide;hydrochloride has a molecular weight of 223.69 g/mol, XLogP of 0.04, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinylbenzenesulfonamide;hydrochloride is sourced from PubChem (CID 2794567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).