N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide

C8H7ClN4O2S — CID 78945043

IUPACN-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)nc1)c1cn[nH]c1
InChIInChI=1S/C8H7ClN4O2S/c9-8-2-1-6(3-10-8)13-16(14,15)7-4-11-12-5-7/h1-5,13H,(H,11,12)
InChIKeyGCSGDWCEEIQMLJ-UHFFFAOYSA-N
MW258.69 g/mol
LogP1.26
Rot. Bonds3

About N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide

N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide (PubChem CID 78945043) has the molecular formula C8H7ClN4O2S and a molecular weight of 258.69 g/mol. Its IUPAC name is N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide
PubChem CID78945043
Molecular FormulaC8H7ClN4O2S
Molecular Weight258.69 g/mol
Exact Mass258.00
IUPAC NameN-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)nc1)c1cn[nH]c1
InChIInChI=1S/C8H7ClN4O2S/c9-8-2-1-6(3-10-8)13-16(14,15)7-4-11-12-5-7/h1-5,13H,(H,11,12)
InChIKeyGCSGDWCEEIQMLJ-UHFFFAOYSA-N
XLogP1.26
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.69
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-bromo-6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide
CID 105055698
N-[4-(aminomethyl)phenyl]-1H-pyrazole-4-sulfonamide
CID 54936916
N-(3,4-difluorophenyl)-1H-pyrazole-4-sulfonamide
CID 60912012
N-(3-chloro-4-cyanophenyl)-1H-pyrazole-4-sulfonamide
CID 54937392
N-[4-(1-aminoethyl)phenyl]-1H-pyrazole-4-sulfonamide
CID 54937351
N-(3-bromo-4-fluorophenyl)-1H-pyrazole-4-sulfonamide
CID 115663189
N-(4-amino-3-bromophenyl)-1H-pyrazole-4-sulfonamide
CID 82861812
1-methyl-3-[4-(1H-pyrazol-4-ylsulfonylamino)phenyl]urea
CID 47364024
N-[4-(1H-imidazol-5-yl)phenyl]-1H-pyrazole-4-sulfonamide
CID 61275741
N-(2,4-dichlorophenyl)-1H-pyrazole-4-sulfonamide
CID 47267509
4-amino-N-(6-chloro-3-pyridinyl)-3-fluorobenzenesulfonamide
CID 82844123
4-chloro-N-(6-chloro-3-pyridinyl)-3-(trifluoromethyl)benzenesulfonamide
CID 56532242

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide (CID 78945043) is N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide is O=S(=O)(Nc1ccc(Cl)nc1)c1cn[nH]c1.
What is the InChIKey of N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide?
The InChIKey is GCSGDWCEEIQMLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClN4O2S/c9-8-2-1-6(3-10-8)13-16(14,15)7-4-11-12-5-7/h1-5,13H,(H,11,12).
What are the key properties of N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide?
N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide has a molecular weight of 258.69 g/mol, XLogP of 1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-3-pyridinyl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 78945043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).