N-(3,4-dimethylphenyl)benzenesulfonohydrazide

C14H16N2O2S — CID 156650628

IUPACN-(3,4-dimethylphenyl)benzenesulfonohydrazide
SMILESCc1ccc(N(N)S(=O)(=O)c2ccccc2)cc1C
InChIInChI=1S/C14H16N2O2S/c1-11-8-9-13(10-12(11)2)16(15)19(17,18)14-6-4-3-5-7-14/h3-10H,15H2,1-2H3
InChIKeyXWKSZCVESFDDQH-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.37
Rot. Bonds3

About N-(3,4-dimethylphenyl)benzenesulfonohydrazide

N-(3,4-dimethylphenyl)benzenesulfonohydrazide (PubChem CID 156650628) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)benzenesulfonohydrazide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)benzenesulfonohydrazide
PubChem CID156650628
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN-(3,4-dimethylphenyl)benzenesulfonohydrazide
SMILESCc1ccc(N(N)S(=O)(=O)c2ccccc2)cc1C
InChIInChI=1S/C14H16N2O2S/c1-11-8-9-13(10-12(11)2)16(15)19(17,18)14-6-4-3-5-7-14/h3-10H,15H2,1-2H3
InChIKeyXWKSZCVESFDDQH-UHFFFAOYSA-N
XLogP2.37
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

N-(3,4-dimethylphenyl)-N-(2-hydrazinyl-2-oxoethyl)benzenesulfonamide
CID 91671580
N-(3,4-dimethylphenyl)-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 110360936
N-pyrimidin-2-ylbenzenesulfonohydrazide
CID 67916952
2-[N-(benzenesulfonyl)-3,4-dimethylanilino]-N-(2,5-dimethylphenyl)acetamide
CID 51345250
2-[N-(benzenesulfonyl)-3,4-dimethylanilino]-N-propan-2-ylacetamide
CID 51345236
2-[N-(benzenesulfonyl)-3,4-dimethylanilino]-N-(2,6-dimethylphenyl)acetamide
CID 51345251
N-(2,6-dimethylpyrimidin-4-yl)benzenesulfonohydrazide
CID 164801074
2-(3,4-dimethyl-N-(4-methylphenyl)sulfonylanilino)-N-phenylacetamide
CID 51345395
4-methyl-N-(2-methylphenyl)benzenesulfonohydrazide
CID 175041346
N-(3,4-dimethylphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 23605192
[4-[benzenesulfonyl(methyl)amino]phenyl] 3,4-dimethylbenzoate
CID 71904341
N-(3,4-dimethylphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide
CID 51345243

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)benzenesulfonohydrazide?
The IUPAC name of N-(3,4-dimethylphenyl)benzenesulfonohydrazide (CID 156650628) is N-(3,4-dimethylphenyl)benzenesulfonohydrazide.
What is the SMILES notation for N-(3,4-dimethylphenyl)benzenesulfonohydrazide?
The canonical SMILES for N-(3,4-dimethylphenyl)benzenesulfonohydrazide is Cc1ccc(N(N)S(=O)(=O)c2ccccc2)cc1C.
What is the InChIKey of N-(3,4-dimethylphenyl)benzenesulfonohydrazide?
The InChIKey is XWKSZCVESFDDQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-11-8-9-13(10-12(11)2)16(15)19(17,18)14-6-4-3-5-7-14/h3-10H,15H2,1-2H3.
What are the key properties of N-(3,4-dimethylphenyl)benzenesulfonohydrazide?
N-(3,4-dimethylphenyl)benzenesulfonohydrazide has a molecular weight of 276.36 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)benzenesulfonohydrazide is sourced from PubChem (CID 156650628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).