2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide

C19H17N3O4S — CID 92646313

IUPAC2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1
InChIInChI=1S/C19H17N3O4S/c1-26-18-7-3-2-6-17(18)19(23)21-14-8-10-16(11-9-14)27(24,25)22-15-5-4-12-20-13-15/h2-13,22H,1H3,(H,21,23)
InChIKeyVUJZHYIGXITBDI-UHFFFAOYSA-N
MW383.43 g/mol
LogP3.14
Rot. Bonds6

About 2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide

2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide (PubChem CID 92646313) has the molecular formula C19H17N3O4S and a molecular weight of 383.43 g/mol. Its IUPAC name is 2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
PubChem CID92646313
Molecular FormulaC19H17N3O4S
Molecular Weight383.43 g/mol
Exact Mass383.09
IUPAC Name2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1
InChIInChI=1S/C19H17N3O4S/c1-26-18-7-3-2-6-17(18)19(23)21-14-8-10-16(11-9-14)27(24,25)22-15-5-4-12-20-13-15/h2-13,22H,1H3,(H,21,23)
InChIKeyVUJZHYIGXITBDI-UHFFFAOYSA-N
XLogP3.14
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.43
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
The IUPAC name of 2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide (CID 92646313) is 2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide is COc1ccccc1C(=O)Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1.
What is the InChIKey of 2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
The InChIKey is VUJZHYIGXITBDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O4S/c1-26-18-7-3-2-6-17(18)19(23)21-14-8-10-16(11-9-14)27(24,25)22-15-5-4-12-20-13-15/h2-13,22H,1H3,(H,21,23).
What are the key properties of 2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide has a molecular weight of 383.43 g/mol, XLogP of 3.14, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 92646313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).