2-hydrazinylbenzenesulfonamide

C6H9N3O2S — CID 11206245

IUPAC2-hydrazinylbenzenesulfonamide
SMILESNNc1ccccc1S(N)(=O)=O
InChIInChI=1S/C6H9N3O2S/c7-9-5-3-1-2-4-6(5)12(8,10)11/h1-4,9H,7H2,(H2,8,10,11)
InChIKeyCTEZEDIMFASQNI-UHFFFAOYSA-N
MW187.22 g/mol
LogP-0.38
Rot. Bonds2

About 2-hydrazinylbenzenesulfonamide

2-hydrazinylbenzenesulfonamide (PubChem CID 11206245) has the molecular formula C6H9N3O2S and a molecular weight of 187.22 g/mol. Its IUPAC name is 2-hydrazinylbenzenesulfonamide.

Molecular Properties

Compound Name2-hydrazinylbenzenesulfonamide
PubChem CID11206245
Molecular FormulaC6H9N3O2S
Molecular Weight187.22 g/mol
Exact Mass187.04
IUPAC Name2-hydrazinylbenzenesulfonamide
SMILESNNc1ccccc1S(N)(=O)=O
InChIInChI=1S/C6H9N3O2S/c7-9-5-3-1-2-4-6(5)12(8,10)11/h1-4,9H,7H2,(H2,8,10,11)
InChIKeyCTEZEDIMFASQNI-UHFFFAOYSA-N
XLogP-0.38
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.22
LogP ≤ 5-0.38
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 2-hydrazinylbenzenesulfonamide?
The IUPAC name of 2-hydrazinylbenzenesulfonamide (CID 11206245) is 2-hydrazinylbenzenesulfonamide.
What is the SMILES notation for 2-hydrazinylbenzenesulfonamide?
The canonical SMILES for 2-hydrazinylbenzenesulfonamide is NNc1ccccc1S(N)(=O)=O.
What is the InChIKey of 2-hydrazinylbenzenesulfonamide?
The InChIKey is CTEZEDIMFASQNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2S/c7-9-5-3-1-2-4-6(5)12(8,10)11/h1-4,9H,7H2,(H2,8,10,11).
What are the key properties of 2-hydrazinylbenzenesulfonamide?
2-hydrazinylbenzenesulfonamide has a molecular weight of 187.22 g/mol, XLogP of -0.38, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinylbenzenesulfonamide is sourced from PubChem (CID 11206245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).