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

C13H12ClN3O3S — CID 62339142

IUPACN-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide
SMILESCc1cccnc1C(=O)Nc1ccc(S(N)(=O)=O)c(Cl)c1
InChIInChI=1S/C13H12ClN3O3S/c1-8-3-2-6-16-12(8)13(18)17-9-4-5-11(10(14)7-9)21(15,19)20/h2-7H,1H3,(H,17,18)(H2,15,19,20)
InChIKeyJICIWQCFTXHBPX-UHFFFAOYSA-N
MW325.78 g/mol
LogP1.94
Rot. Bonds3

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

N-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide (PubChem CID 62339142) has the molecular formula C13H12ClN3O3S and a molecular weight of 325.78 g/mol. Its IUPAC name is N-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide
PubChem CID62339142
Molecular FormulaC13H12ClN3O3S
Molecular Weight325.78 g/mol
Exact Mass325.03
IUPAC NameN-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide
SMILESCc1cccnc1C(=O)Nc1ccc(S(N)(=O)=O)c(Cl)c1
InChIInChI=1S/C13H12ClN3O3S/c1-8-3-2-6-16-12(8)13(18)17-9-4-5-11(10(14)7-9)21(15,19)20/h2-7H,1H3,(H,17,18)(H2,15,19,20)
InChIKeyJICIWQCFTXHBPX-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

3-methyl-N-(3-methyl-4-sulfamoylphenyl)pyridine-2-carboxamide
CID 62339318
3-bromo-N-(3-methyl-4-sulfamoylphenyl)pyridine-2-carboxamide
CID 107519556
3-methyl-N-(2-sulfamoylphenyl)pyridine-2-carboxamide
CID 62340174
N-(4-bromo-3-methylphenyl)-3-methylpyridine-2-carboxamide
CID 62338956
3-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-2-carboxamide
CID 62340011
3-hydroxy-N-(3-methoxy-4-sulfamoylphenyl)pyridine-2-carboxamide
CID 167828316
N-(3-chloro-4-methylphenyl)-3-fluoropyridine-2-carboxamide
CID 110474858
N-(3-chloro-4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide
CID 63023211
3-chloro-N-(3-chloro-4-sulfamoylphenyl)benzamide
CID 43246493
N-(4-iodophenyl)-3-methylpyridine-2-carboxamide
CID 62339482
N-(5-amino-2-chlorophenyl)-3-methylpyridine-2-carboxamide
CID 55059942
N-(3-chloro-4-sulfamoylphenyl)-3-fluoropyridine-4-carboxamide
CID 64951270

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide?
The IUPAC name of N-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide (CID 62339142) is N-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide.
What is the SMILES notation for N-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide?
The canonical SMILES for N-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide is Cc1cccnc1C(=O)Nc1ccc(S(N)(=O)=O)c(Cl)c1.
What is the InChIKey of N-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide?
The InChIKey is JICIWQCFTXHBPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClN3O3S/c1-8-3-2-6-16-12(8)13(18)17-9-4-5-11(10(14)7-9)21(15,19)20/h2-7H,1H3,(H,17,18)(H2,15,19,20).
What are the key properties of N-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide?
N-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-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-(3-chloro-4-sulfamoylphenyl)-3-methylpyridine-2-carboxamide is sourced from PubChem (CID 62339142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).