5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide

C17H15FN4O3S — CID 53115571

IUPAC5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide
SMILESCc1cccc(NC(=O)c2cn[nH]c2S(=O)(=O)Nc2ccc(F)cc2)c1
InChIInChI=1S/C17H15FN4O3S/c1-11-3-2-4-14(9-11)20-16(23)15-10-19-21-17(15)26(24,25)22-13-7-5-12(18)6-8-13/h2-10,22H,1H3,(H,19,21)(H,20,23)
InChIKeyUQFGKAIMBQRTHQ-UHFFFAOYSA-N
MW374.40 g/mol
LogP2.91
Rot. Bonds5

About 5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide

5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide (PubChem CID 53115571) has the molecular formula C17H15FN4O3S and a molecular weight of 374.40 g/mol. Its IUPAC name is 5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide
PubChem CID53115571
Molecular FormulaC17H15FN4O3S
Molecular Weight374.40 g/mol
Exact Mass374.08
IUPAC Name5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide
SMILESCc1cccc(NC(=O)c2cn[nH]c2S(=O)(=O)Nc2ccc(F)cc2)c1
InChIInChI=1S/C17H15FN4O3S/c1-11-3-2-4-14(9-11)20-16(23)15-10-19-21-17(15)26(24,25)22-13-7-5-12(18)6-8-13/h2-10,22H,1H3,(H,19,21)(H,20,23)
InChIKeyUQFGKAIMBQRTHQ-UHFFFAOYSA-N
XLogP2.91
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 52.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide (CID 53115571) is 5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide is Cc1cccc(NC(=O)c2cn[nH]c2S(=O)(=O)Nc2ccc(F)cc2)c1.
What is the InChIKey of 5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide?
The InChIKey is UQFGKAIMBQRTHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN4O3S/c1-11-3-2-4-14(9-11)20-16(23)15-10-19-21-17(15)26(24,25)22-13-7-5-12(18)6-8-13/h2-10,22H,1H3,(H,19,21)(H,20,23).
What are the key properties of 5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide?
5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide has a molecular weight of 374.40 g/mol, XLogP of 2.91, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 53115571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).