N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide

C17H13N5O3S — CID 155512734

IUPACN-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide
SMILESN#Cc1cnn(-c2ccc(S(N)(=O)=O)cc2)c1NC(=O)c1ccccc1
InChIInChI=1S/C17H13N5O3S/c18-10-13-11-20-22(14-6-8-15(9-7-14)26(19,24)25)16(13)21-17(23)12-4-2-1-3-5-12/h1-9,11H,(H,21,23)(H2,19,24,25)
InChIKeyWEUHPBJZVFOCIY-UHFFFAOYSA-N
MW367.39 g/mol
LogP1.64
Rot. Bonds4

About N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide

N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide (PubChem CID 155512734) has the molecular formula C17H13N5O3S and a molecular weight of 367.39 g/mol. Its IUPAC name is N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide.

Molecular Properties

Compound NameN-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide
PubChem CID155512734
Molecular FormulaC17H13N5O3S
Molecular Weight367.39 g/mol
Exact Mass367.07
IUPAC NameN-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide
SMILESN#Cc1cnn(-c2ccc(S(N)(=O)=O)cc2)c1NC(=O)c1ccccc1
InChIInChI=1S/C17H13N5O3S/c18-10-13-11-20-22(14-6-8-15(9-7-14)26(19,24)25)16(13)21-17(23)12-4-2-1-3-5-12/h1-9,11H,(H,21,23)(H2,19,24,25)
InChIKeyWEUHPBJZVFOCIY-UHFFFAOYSA-N
XLogP1.64
TPSA130.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.39
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide?
The IUPAC name of N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide (CID 155512734) is N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide.
What is the SMILES notation for N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide?
The canonical SMILES for N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide is N#Cc1cnn(-c2ccc(S(N)(=O)=O)cc2)c1NC(=O)c1ccccc1.
What is the InChIKey of N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide?
The InChIKey is WEUHPBJZVFOCIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5O3S/c18-10-13-11-20-22(14-6-8-15(9-7-14)26(19,24)25)16(13)21-17(23)12-4-2-1-3-5-12/h1-9,11H,(H,21,23)(H2,19,24,25).
What are the key properties of N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide?
N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide has a molecular weight of 367.39 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-cyano-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzamide is sourced from PubChem (CID 155512734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).