N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide

C12H9ClN2O3S — CID 57403366

IUPACN-(4-chlorophenyl)sulfonylpyridine-4-carboxamide
SMILESO=C(NS(=O)(=O)c1ccc(Cl)cc1)c1ccncc1
InChIInChI=1S/C12H9ClN2O3S/c13-10-1-3-11(4-2-10)19(17,18)15-12(16)9-5-7-14-8-6-9/h1-8H,(H,15,16)
InChIKeyHJOZSCMVCHEQAP-UHFFFAOYSA-N
MW296.74 g/mol
LogP1.85
Rot. Bonds3

About N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide

N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide (PubChem CID 57403366) has the molecular formula C12H9ClN2O3S and a molecular weight of 296.74 g/mol. Its IUPAC name is N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)sulfonylpyridine-4-carboxamide
PubChem CID57403366
Molecular FormulaC12H9ClN2O3S
Molecular Weight296.74 g/mol
Exact Mass296.00
IUPAC NameN-(4-chlorophenyl)sulfonylpyridine-4-carboxamide
SMILESO=C(NS(=O)(=O)c1ccc(Cl)cc1)c1ccncc1
InChIInChI=1S/C12H9ClN2O3S/c13-10-1-3-11(4-2-10)19(17,18)15-12(16)9-5-7-14-8-6-9/h1-8H,(H,15,16)
InChIKeyHJOZSCMVCHEQAP-UHFFFAOYSA-N
XLogP1.85
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.74
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide 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'-isonicotinoylbenzenesulfonohydrazide
CID 468603
2-Chloroisonicotinamide
CID 2800022
4-chloro-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 710402
4-pyridyl-N-[2-(4-sulfamoylphenyl)ethyl]carboxamide
CID 2108328
6-chloro-N-(4-piperidin-1-ylsulfonylphenyl)pyridine-3-carboxamide
CID 2121872
2-chloro-N-[(4-sulfamoylphenyl)methyl]pyridine-3-carboxamide
CID 3361061
N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)pyridine-4-carboxamide
CID 5137553
4-chloro-N-[(Z)-1-pyridin-4-ylethylideneamino]benzenesulfonamide
CID 6157925
4-Carbamoyl-1-(2-chloro-benzyl)-pyridinium
CID 23724235
N-(3-{N-[(4-chlorophenyl)sulfonyl]ethanehydrazonoyl}phenyl)isonicotinamide
CID 5454652
8-(4-Chloro-benzenesulfonylamino)-4-(3-pyridin-3-yl-propyl)-octanoic acid amide
CID 10072535
4-[[(4-chlorophenyl)sulfonylamino]methyl]-N-pyridin-3-ylbenzamide
CID 59053520

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide?
The IUPAC name of N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide (CID 57403366) is N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide is O=C(NS(=O)(=O)c1ccc(Cl)cc1)c1ccncc1.
What is the InChIKey of N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide?
The InChIKey is HJOZSCMVCHEQAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN2O3S/c13-10-1-3-11(4-2-10)19(17,18)15-12(16)9-5-7-14-8-6-9/h1-8H,(H,15,16).
What are the key properties of N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide?
N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide has a molecular weight of 296.74 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)sulfonylpyridine-4-carboxamide is sourced from PubChem (CID 57403366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).