N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide

C13H16N4O2S — CID 103300898

IUPACN-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide
SMILESCc1cc(C)cc(NS(=O)(=O)c2ncccc2NN)c1
InChIInChI=1S/C13H16N4O2S/c1-9-6-10(2)8-11(7-9)17-20(18,19)13-12(16-14)4-3-5-15-13/h3-8,16-17H,14H2,1-2H3
InChIKeyOBZQUCMRRYMCQW-UHFFFAOYSA-N
MW292.36 g/mol
LogP1.78
Rot. Bonds4

About N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide

N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide (PubChem CID 103300898) has the molecular formula C13H16N4O2S and a molecular weight of 292.36 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide
PubChem CID103300898
Molecular FormulaC13H16N4O2S
Molecular Weight292.36 g/mol
Exact Mass292.10
IUPAC NameN-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide
SMILESCc1cc(C)cc(NS(=O)(=O)c2ncccc2NN)c1
InChIInChI=1S/C13H16N4O2S/c1-9-6-10(2)8-11(7-9)17-20(18,19)13-12(16-14)4-3-5-15-13/h3-8,16-17H,14H2,1-2H3
InChIKeyOBZQUCMRRYMCQW-UHFFFAOYSA-N
XLogP1.78
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 51.78
H-Bond Donors ≤ 53
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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Related Compounds

N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304016
N-(3-chloro-4-methylphenyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103300777
3-hydrazinyl-N-(3-propan-2-ylphenyl)pyridine-2-sulfonamide
CID 103300935
3-hydrazinyl-N-(2,4,5-trichlorophenyl)pyridine-2-sulfonamide
CID 103300792
N-(4-fluoro-2-methylphenyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103300908
N-(4-chloro-3-methoxyphenyl)-3-hydrazinylpyridine-2-sulfonamide
CID 107622147
N-(2,6-dichloro-4-fluorophenyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103301917
N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-hydrazinylpyridine-2-sulfonamide
CID 103301102
3-(methylamino)-N-(2,4,6-trimethylphenyl)pyridine-2-sulfonamide
CID 103303080
N-(5-chloro-2-fluorophenyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103300976
N-(3-cyano-4-fluorophenyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103301404
3-hydrazinyl-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide
CID 103300842

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide?
The IUPAC name of N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide (CID 103300898) is N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide is Cc1cc(C)cc(NS(=O)(=O)c2ncccc2NN)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide?
The InChIKey is OBZQUCMRRYMCQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2S/c1-9-6-10(2)8-11(7-9)17-20(18,19)13-12(16-14)4-3-5-15-13/h3-8,16-17H,14H2,1-2H3.
What are the key properties of N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide?
N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide has a molecular weight of 292.36 g/mol, XLogP of 1.78, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide is sourced from PubChem (CID 103300898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).