N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide

C13H12ClN3O3S — CID 43134081

IUPACN-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(S(N)(=O)=O)cc2Cl)cn1
InChIInChI=1S/C13H12ClN3O3S/c1-8-2-3-9(7-16-8)13(18)17-12-5-4-10(6-11(12)14)21(15,19)20/h2-7H,1H3,(H,17,18)(H2,15,19,20)
InChIKeyMXRZKJAYDJYEFU-UHFFFAOYSA-N
MW325.78 g/mol
LogP1.94
Rot. Bonds3

About N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide

N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide (PubChem CID 43134081) has the molecular formula C13H12ClN3O3S and a molecular weight of 325.78 g/mol. Its IUPAC name is N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide
PubChem CID43134081
Molecular FormulaC13H12ClN3O3S
Molecular Weight325.78 g/mol
Exact Mass325.03
IUPAC NameN-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(S(N)(=O)=O)cc2Cl)cn1
InChIInChI=1S/C13H12ClN3O3S/c1-8-2-3-9(7-16-8)13(18)17-12-5-4-10(6-11(12)14)21(15,19)20/h2-7H,1H3,(H,17,18)(H2,15,19,20)
InChIKeyMXRZKJAYDJYEFU-UHFFFAOYSA-N
XLogP1.94
TPSA102.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.78
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide
CID 43134088
N-(2-chloro-4-cyanophenyl)-6-methylpyridine-3-carboxamide
CID 103799813
5-bromo-N-(2-chloro-4-sulfamoylphenyl)pyridine-2-carboxamide
CID 62958134
N-(2-bromo-4-chlorophenyl)-6-methylpyridine-3-carboxamide
CID 81024583
N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide
CID 43246544
N-(4-chloro-2-methylphenyl)-6-methylpyridine-3-carboxamide
CID 18148116
N-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide
CID 18149498
N-(3-fluoro-5-sulfamoylphenyl)-6-methylpyridine-3-carboxamide
CID 51975647
N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-3-carboxamide
CID 51331568
N-(2-bromo-5-chlorophenyl)-6-methylpyridine-3-carboxamide
CID 81272102
N-(6-chloro-1,3-benzodioxol-5-yl)-6-methylpyridine-3-carboxamide
CID 18158591
N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66475777

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide?
The IUPAC name of N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide (CID 43134081) is N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide is Cc1ccc(C(=O)Nc2ccc(S(N)(=O)=O)cc2Cl)cn1.
What is the InChIKey of N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide?
The InChIKey is MXRZKJAYDJYEFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClN3O3S/c1-8-2-3-9(7-16-8)13(18)17-12-5-4-10(6-11(12)14)21(15,19)20/h2-7H,1H3,(H,17,18)(H2,15,19,20).
What are the key properties of N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide?
N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide has a molecular weight of 325.78 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 43134081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).