4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide

C13H13N3O4S — CID 56684238

IUPAC4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide
SMILESCOc1ccc(C(N)=O)cc1S(=O)(=O)Nc1cccnc1
InChIInChI=1S/C13H13N3O4S/c1-20-11-5-4-9(13(14)17)7-12(11)21(18,19)16-10-3-2-6-15-8-10/h2-8,16H,1H3,(H2,14,17)
InChIKeyXDZBHPSEGNJVSE-UHFFFAOYSA-N
MW307.33 g/mol
LogP0.99
Rot. Bonds5

About 4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide

4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide (PubChem CID 56684238) has the molecular formula C13H13N3O4S and a molecular weight of 307.33 g/mol. Its IUPAC name is 4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide.

Molecular Properties

Compound Name4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide
PubChem CID56684238
Molecular FormulaC13H13N3O4S
Molecular Weight307.33 g/mol
Exact Mass307.06
IUPAC Name4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide
SMILESCOc1ccc(C(N)=O)cc1S(=O)(=O)Nc1cccnc1
InChIInChI=1S/C13H13N3O4S/c1-20-11-5-4-9(13(14)17)7-12(11)21(18,19)16-10-3-2-6-15-8-10/h2-8,16H,1H3,(H2,14,17)
InChIKeyXDZBHPSEGNJVSE-UHFFFAOYSA-N
XLogP0.99
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.33
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide?
The IUPAC name of 4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide (CID 56684238) is 4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide.
What is the SMILES notation for 4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide?
The canonical SMILES for 4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide is COc1ccc(C(N)=O)cc1S(=O)(=O)Nc1cccnc1.
What is the InChIKey of 4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide?
The InChIKey is XDZBHPSEGNJVSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O4S/c1-20-11-5-4-9(13(14)17)7-12(11)21(18,19)16-10-3-2-6-15-8-10/h2-8,16H,1H3,(H2,14,17).
What are the key properties of 4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide?
4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide has a molecular weight of 307.33 g/mol, XLogP of 0.99, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-(pyridin-3-ylsulfamoyl)benzamide is sourced from PubChem (CID 56684238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).