N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide

C13H16N4O2S — CID 61004704

IUPACN-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide
SMILESCc1ccc(C)c(NS(=O)(=O)c2ccnc(NN)c2)c1
InChIInChI=1S/C13H16N4O2S/c1-9-3-4-10(2)12(7-9)17-20(18,19)11-5-6-15-13(8-11)16-14/h3-8,17H,14H2,1-2H3,(H,15,16)
InChIKeyYYTGAYSKHYEZGV-UHFFFAOYSA-N
MW292.36 g/mol
LogP1.78
Rot. Bonds4

About N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide

N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide (PubChem CID 61004704) has the molecular formula C13H16N4O2S and a molecular weight of 292.36 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide
PubChem CID61004704
Molecular FormulaC13H16N4O2S
Molecular Weight292.36 g/mol
Exact Mass292.10
IUPAC NameN-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide
SMILESCc1ccc(C)c(NS(=O)(=O)c2ccnc(NN)c2)c1
InChIInChI=1S/C13H16N4O2S/c1-9-3-4-10(2)12(7-9)17-20(18,19)11-5-6-15-13(8-11)16-14/h3-8,17H,14H2,1-2H3,(H,15,16)
InChIKeyYYTGAYSKHYEZGV-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-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide
CID 62148688
N-(3-bromo-5-methylphenyl)-2-hydrazinylpyridine-4-sulfonamide
CID 107584202
N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide
CID 62143380
2-hydrazinyl-N-(2-iodophenyl)pyridine-4-sulfonamide
CID 54895973
2-amino-N-(2-bromo-5-methylphenyl)pyridine-4-sulfonamide
CID 82758264
N-(4-fluoro-3-methylphenyl)-2-hydrazinylpyridine-4-sulfonamide
CID 62812201
N-(2,5-dimethylphenyl)-3-methylbenzenesulfonamide
CID 47104321
N-(2-bromo-4-methylphenyl)-2-(ethylamino)pyridine-4-sulfonamide
CID 62164386
N-(2-chloro-4-iodophenyl)-2-hydrazinylpyridine-4-sulfonamide
CID 107605710
6-chloro-N-(2,5-dimethylphenyl)pyridine-3-sulfonamide
CID 4729843
4-bromo-N-(2,5-dimethylphenyl)benzenesulfonamide
CID 4517500
2-hydrazinyl-N-(thiatriazol-5-yl)pyridine-4-sulfonamide
CID 114912904

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide?
The IUPAC name of N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide (CID 61004704) is N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide is Cc1ccc(C)c(NS(=O)(=O)c2ccnc(NN)c2)c1.
What is the InChIKey of N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide?
The InChIKey is YYTGAYSKHYEZGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2S/c1-9-3-4-10(2)12(7-9)17-20(18,19)11-5-6-15-13(8-11)16-14/h3-8,17H,14H2,1-2H3,(H,15,16).
What are the key properties of N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide?
N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-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-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide is sourced from PubChem (CID 61004704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).