N-(pyridin-3-ylmethylsulfamoyl)benzamide

C13H13N3O3S — CID 142724613

IUPACN-(pyridin-3-ylmethylsulfamoyl)benzamide
SMILESO=C(NS(=O)(=O)NCc1cccnc1)c1ccccc1
InChIInChI=1S/C13H13N3O3S/c17-13(12-6-2-1-3-7-12)16-20(18,19)15-10-11-5-4-8-14-9-11/h1-9,15H,10H2,(H,16,17)
InChIKeyXYSXWTGVSOJIOI-UHFFFAOYSA-N
MW291.33 g/mol
LogP0.85
Rot. Bonds5

About N-(pyridin-3-ylmethylsulfamoyl)benzamide

N-(pyridin-3-ylmethylsulfamoyl)benzamide (PubChem CID 142724613) has the molecular formula C13H13N3O3S and a molecular weight of 291.33 g/mol. Its IUPAC name is N-(pyridin-3-ylmethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(pyridin-3-ylmethylsulfamoyl)benzamide
PubChem CID142724613
Molecular FormulaC13H13N3O3S
Molecular Weight291.33 g/mol
Exact Mass291.07
IUPAC NameN-(pyridin-3-ylmethylsulfamoyl)benzamide
SMILESO=C(NS(=O)(=O)NCc1cccnc1)c1ccccc1
InChIInChI=1S/C13H13N3O3S/c17-13(12-6-2-1-3-7-12)16-20(18,19)15-10-11-5-4-8-14-9-11/h1-9,15H,10H2,(H,16,17)
InChIKeyXYSXWTGVSOJIOI-UHFFFAOYSA-N
XLogP0.85
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-phenyl-N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]benzamide
CID 110345177
N-(2-phenylethyl)-4-(pyridin-3-ylmethylsulfamoyl)benzamide
CID 109060926
4-fluoro-N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]benzamide
CID 7618448
N-[4-(pyridin-3-ylmethoxy)phenyl]sulfonylbenzamide
CID 144935099
N-benzylpyridine-3-carboxamide chloride
CID 21204170
N-(pyridin-3-ylmethyl)pyridine-3-carboxamide;hydrochloride
CID 110755498
3-oxo-3-phenyl-N-(pyridin-3-ylmethyl)propanamide
CID 102234842
N-propan-2-yl-4-(pyridin-3-ylmethylsulfamoyl)benzamide
CID 109058145
6-(pyridin-3-ylmethylsulfamoyl)pyridine-3-carboxylic acid
CID 63872025
N-[3-[(pyridin-3-ylmethylamino)methyl]phenyl]benzamide
CID 167788659
N-[1-oxo-3-phenyl-1-(pyridin-3-ylmethylamino)propan-2-yl]benzamide
CID 2972339
3-(pyridin-3-ylmethylcarbamoyl)benzoic acid
CID 43452921

Frequently Asked Questions

What is the IUPAC name of N-(pyridin-3-ylmethylsulfamoyl)benzamide?
The IUPAC name of N-(pyridin-3-ylmethylsulfamoyl)benzamide (CID 142724613) is N-(pyridin-3-ylmethylsulfamoyl)benzamide.
What is the SMILES notation for N-(pyridin-3-ylmethylsulfamoyl)benzamide?
The canonical SMILES for N-(pyridin-3-ylmethylsulfamoyl)benzamide is O=C(NS(=O)(=O)NCc1cccnc1)c1ccccc1.
What is the InChIKey of N-(pyridin-3-ylmethylsulfamoyl)benzamide?
The InChIKey is XYSXWTGVSOJIOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O3S/c17-13(12-6-2-1-3-7-12)16-20(18,19)15-10-11-5-4-8-14-9-11/h1-9,15H,10H2,(H,16,17).
What are the key properties of N-(pyridin-3-ylmethylsulfamoyl)benzamide?
N-(pyridin-3-ylmethylsulfamoyl)benzamide has a molecular weight of 291.33 g/mol, XLogP of 0.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-3-ylmethylsulfamoyl)benzamide is sourced from PubChem (CID 142724613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).