N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide

C12H10ClN5O2S — CID 43456936

IUPACN-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide
SMILESN#Cc1ccc(NS(=O)(=O)c2cccnc2NN)cc1Cl
InChIInChI=1S/C12H10ClN5O2S/c13-10-6-9(4-3-8(10)7-14)18-21(19,20)11-2-1-5-16-12(11)17-15/h1-6,18H,15H2,(H,16,17)
InChIKeyUUFQOQBNYZRHNT-UHFFFAOYSA-N
MW323.77 g/mol
LogP1.69
Rot. Bonds4

About N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide

N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide (PubChem CID 43456936) has the molecular formula C12H10ClN5O2S and a molecular weight of 323.77 g/mol. Its IUPAC name is N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide
PubChem CID43456936
Molecular FormulaC12H10ClN5O2S
Molecular Weight323.77 g/mol
Exact Mass323.02
IUPAC NameN-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide
SMILESN#Cc1ccc(NS(=O)(=O)c2cccnc2NN)cc1Cl
InChIInChI=1S/C12H10ClN5O2S/c13-10-6-9(4-3-8(10)7-14)18-21(19,20)11-2-1-5-16-12(11)17-15/h1-6,18H,15H2,(H,16,17)
InChIKeyUUFQOQBNYZRHNT-UHFFFAOYSA-N
XLogP1.69
TPSA120.90 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.77
LogP ≤ 51.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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-(4-chloro-3-fluorophenyl)-2-hydrazinylpyridine-3-sulfonamide
CID 61468313
N-(4-chlorophenyl)-2-hydrazinylpyridine-3-sulfonamide
CID 43456810
N-(3,4-dimethylphenyl)-2-hydrazinylpyridine-3-sulfonamide
CID 43456741
N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-4-sulfonamide
CID 61004459
N-[4-(cyanomethyl)phenyl]-2-hydrazinylpyridine-3-sulfonamide
CID 62301529
3-amino-N-(3-chloro-4-cyanophenyl)-2-methylbenzenesulfonamide
CID 43347895
N-(3-bromophenyl)-2-hydrazinylpyridine-3-sulfonamide
CID 43456824
N-(1,3-benzodioxol-5-yl)-2-hydrazinylpyridine-3-sulfonamide
CID 43456605
3-chloro-4-cyano-N-(3,4-dichlorophenyl)benzenesulfonamide
CID 115588612
6-chloro-N-(3-chloro-4-cyanophenyl)pyridine-3-sulfonamide
CID 43236398
4-amino-N-(3-chloro-2-pyridinyl)-2-cyanobenzenesulfonamide
CID 103093927
N-(2-bromo-5-chlorophenyl)-2-hydrazinylpyridine-3-sulfonamide
CID 81279969

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide?
The IUPAC name of N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide (CID 43456936) is N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide.
What is the SMILES notation for N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide?
The canonical SMILES for N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide is N#Cc1ccc(NS(=O)(=O)c2cccnc2NN)cc1Cl.
What is the InChIKey of N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide?
The InChIKey is UUFQOQBNYZRHNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN5O2S/c13-10-6-9(4-3-8(10)7-14)18-21(19,20)11-2-1-5-16-12(11)17-15/h1-6,18H,15H2,(H,16,17).
What are the key properties of N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide?
N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide has a molecular weight of 323.77 g/mol, XLogP of 1.69, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-cyanophenyl)-2-hydrazinylpyridine-3-sulfonamide is sourced from PubChem (CID 43456936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).