4-(methanesulfonamido)-N-pyridin-2-ylbenzamide

C13H13N3O3S — CID 42113789

IUPAC4-(methanesulfonamido)-N-pyridin-2-ylbenzamide
SMILESCS(=O)(=O)Nc1ccc(C(=O)Nc2ccccn2)cc1
InChIInChI=1S/C13H13N3O3S/c1-20(18,19)16-11-7-5-10(6-8-11)13(17)15-12-4-2-3-9-14-12/h2-9,16H,1H3,(H,14,15,17)
InChIKeyYFEAAIGVINQNLY-UHFFFAOYSA-N
MW291.33 g/mol
LogP1.71
Rot. Bonds4

About 4-(methanesulfonamido)-N-pyridin-2-ylbenzamide

4-(methanesulfonamido)-N-pyridin-2-ylbenzamide (PubChem CID 42113789) has the molecular formula C13H13N3O3S and a molecular weight of 291.33 g/mol. Its IUPAC name is 4-(methanesulfonamido)-N-pyridin-2-ylbenzamide.

Molecular Properties

Compound Name4-(methanesulfonamido)-N-pyridin-2-ylbenzamide
PubChem CID42113789
Molecular FormulaC13H13N3O3S
Molecular Weight291.33 g/mol
Exact Mass291.07
IUPAC Name4-(methanesulfonamido)-N-pyridin-2-ylbenzamide
SMILESCS(=O)(=O)Nc1ccc(C(=O)Nc2ccccn2)cc1
InChIInChI=1S/C13H13N3O3S/c1-20(18,19)16-11-7-5-10(6-8-11)13(17)15-12-4-2-3-9-14-12/h2-9,16H,1H3,(H,14,15,17)
InChIKeyYFEAAIGVINQNLY-UHFFFAOYSA-N
XLogP1.71
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-N-methyl-4-N-pyridin-2-ylbenzene-1,4-dicarboxamide
CID 145416212
N-[2-[[4-(methanesulfonamido)benzoyl]amino]ethyl]pyridine-2-carboxamide
CID 108540814
pyrazine;N-pyridin-2-ylbenzamide
CID 158820949
4-(diethylsulfamoyl)-N-pyridin-2-ylbenzamide
CID 46671899
4-arsoroso-N-pyridin-2-ylbenzamide
CID 3027019
N-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide
CID 146154862
4-(methanesulfonamido)-3-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 30396142
N-(4-iodophenyl)-4-(methanesulfonamido)benzamide
CID 1289280
2-[[4-(pyridin-2-ylcarbamoyl)phenyl]carbamoyl]benzoate
CID 6980203
4-ethynyl-N-pyridin-2-ylbenzamide
CID 135042338
4-[[(2S)-butan-2-yl]sulfamoyl]-N-pyridin-2-ylbenzamide
CID 41273948
N-pyridin-2-yl-4-pyrimidin-2-yloxybenzamide
CID 56724080

Frequently Asked Questions

What is the IUPAC name of 4-(methanesulfonamido)-N-pyridin-2-ylbenzamide?
The IUPAC name of 4-(methanesulfonamido)-N-pyridin-2-ylbenzamide (CID 42113789) is 4-(methanesulfonamido)-N-pyridin-2-ylbenzamide.
What is the SMILES notation for 4-(methanesulfonamido)-N-pyridin-2-ylbenzamide?
The canonical SMILES for 4-(methanesulfonamido)-N-pyridin-2-ylbenzamide is CS(=O)(=O)Nc1ccc(C(=O)Nc2ccccn2)cc1.
What is the InChIKey of 4-(methanesulfonamido)-N-pyridin-2-ylbenzamide?
The InChIKey is YFEAAIGVINQNLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O3S/c1-20(18,19)16-11-7-5-10(6-8-11)13(17)15-12-4-2-3-9-14-12/h2-9,16H,1H3,(H,14,15,17).
What are the key properties of 4-(methanesulfonamido)-N-pyridin-2-ylbenzamide?
4-(methanesulfonamido)-N-pyridin-2-ylbenzamide has a molecular weight of 291.33 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methanesulfonamido)-N-pyridin-2-ylbenzamide is sourced from PubChem (CID 42113789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).