N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide

C13H13N3O3S — CID 61129416

IUPACN-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide
SMILESCN(C(=O)c1cccnc1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C13H13N3O3S/c1-16(13(17)10-3-2-8-15-9-10)11-4-6-12(7-5-11)20(14,18)19/h2-9H,1H3,(H2,14,18,19)
InChIKeyVVKHNKQKPYRFPF-UHFFFAOYSA-N
MW291.33 g/mol
LogP1.01
Rot. Bonds3

About N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide

N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide (PubChem CID 61129416) has the molecular formula C13H13N3O3S and a molecular weight of 291.33 g/mol. Its IUPAC name is N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide
PubChem CID61129416
Molecular FormulaC13H13N3O3S
Molecular Weight291.33 g/mol
Exact Mass291.07
IUPAC NameN-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide
SMILESCN(C(=O)c1cccnc1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C13H13N3O3S/c1-16(13(17)10-3-2-8-15-9-10)11-4-6-12(7-5-11)20(14,18)19/h2-9H,1H3,(H2,14,18,19)
InChIKeyVVKHNKQKPYRFPF-UHFFFAOYSA-N
XLogP1.01
TPSA93.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-phenylpyridine-3-carboxamide;hydrochloride
CID 110756365
N,4-dimethyl-N-(4-sulfamoylphenyl)benzamide
CID 61129425
2-[4-[methyl(pyridine-3-carbonyl)amino]phenyl]acetic acid;hydrochloride
CID 52988212
N-[4-(2-aminoethoxy)phenyl]-N-methylpyridine-3-carboxamide
CID 28755886
4-[2-(pyridine-3-carbonyl)hydrazinyl]benzenesulfonamide
CID 10661301
N,6-dimethyl-N-(4-sulfamoylphenyl)pyridine-2-carboxamide
CID 61129781
N-methyl-N-(4-sulfamoylphenyl)-1,2-oxazole-5-carboxamide
CID 61130946
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide
CID 110752821
N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide
CID 174921681
N,N-dimethylpyridine-3-carboxamide;ethane
CID 142562125
N-methyl-N-(4-sulfamoylphenyl)thiadiazole-5-carboxamide
CID 65215734
N-methyl-N-(trifluoromethylsulfonyl)pyridine-3-carboxamide
CID 71032143

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide?
The IUPAC name of N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide (CID 61129416) is N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide?
The canonical SMILES for N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide is CN(C(=O)c1cccnc1)c1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide?
The InChIKey is VVKHNKQKPYRFPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O3S/c1-16(13(17)10-3-2-8-15-9-10)11-4-6-12(7-5-11)20(14,18)19/h2-9H,1H3,(H2,14,18,19).
What are the key properties of N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide?
N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide has a molecular weight of 291.33 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 61129416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).