2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide

C13H14N4O3S — CID 62234840

IUPAC2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide
SMILESNNc1ccccc1C(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C13H14N4O3S/c14-17-12-4-2-1-3-11(12)13(18)16-9-5-7-10(8-6-9)21(15,19)20/h1-8,17H,14H2,(H,16,18)(H2,15,19,20)
InChIKeyRARGXZBSPMEEKY-UHFFFAOYSA-N
MW306.35 g/mol
LogP0.87
Rot. Bonds4

About 2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide

2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide (PubChem CID 62234840) has the molecular formula C13H14N4O3S and a molecular weight of 306.35 g/mol. Its IUPAC name is 2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide.

Molecular Properties

Compound Name2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide
PubChem CID62234840
Molecular FormulaC13H14N4O3S
Molecular Weight306.35 g/mol
Exact Mass306.08
IUPAC Name2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide
SMILESNNc1ccccc1C(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C13H14N4O3S/c14-17-12-4-2-1-3-11(12)13(18)16-9-5-7-10(8-6-9)21(15,19)20/h1-8,17H,14H2,(H,16,18)(H2,15,19,20)
InChIKeyRARGXZBSPMEEKY-UHFFFAOYSA-N
XLogP0.87
TPSA127.31 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.35
LogP ≤ 50.87
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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-hydrazinyl-N-(4-sulfamoylphenyl)benzamide?
The IUPAC name of 2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide (CID 62234840) is 2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide.
What is the SMILES notation for 2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide?
The canonical SMILES for 2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide is NNc1ccccc1C(=O)Nc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide?
The InChIKey is RARGXZBSPMEEKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O3S/c14-17-12-4-2-1-3-11(12)13(18)16-9-5-7-10(8-6-9)21(15,19)20/h1-8,17H,14H2,(H,16,18)(H2,15,19,20).
What are the key properties of 2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide?
2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide has a molecular weight of 306.35 g/mol, XLogP of 0.87, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide is sourced from PubChem (CID 62234840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).