5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide

C15H14N4O3S2 — CID 22315657

IUPAC5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide
SMILESCc1csc(-c2cc(C(N)=O)nn2-c2ccc(S(N)(=O)=O)cc2)c1
InChIInChI=1S/C15H14N4O3S2/c1-9-6-14(23-8-9)13-7-12(15(16)20)18-19(13)10-2-4-11(5-3-10)24(17,21)22/h2-8H,1H3,(H2,16,20)(H2,17,21,22)
InChIKeyMLSAETQBYZOHGQ-UHFFFAOYSA-N
MW362.44 g/mol
LogP1.66
Rot. Bonds4

About 5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide

5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide (PubChem CID 22315657) has the molecular formula C15H14N4O3S2 and a molecular weight of 362.44 g/mol. Its IUPAC name is 5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide
PubChem CID22315657
Molecular FormulaC15H14N4O3S2
Molecular Weight362.44 g/mol
Exact Mass362.05
IUPAC Name5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide
SMILESCc1csc(-c2cc(C(N)=O)nn2-c2ccc(S(N)(=O)=O)cc2)c1
InChIInChI=1S/C15H14N4O3S2/c1-9-6-14(23-8-9)13-7-12(15(16)20)18-19(13)10-2-4-11(5-3-10)24(17,21)22/h2-8H,1H3,(H2,16,20)(H2,17,21,22)
InChIKeyMLSAETQBYZOHGQ-UHFFFAOYSA-N
XLogP1.66
TPSA121.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.44
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide?
The IUPAC name of 5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide (CID 22315657) is 5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide.
What is the SMILES notation for 5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide?
The canonical SMILES for 5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide is Cc1csc(-c2cc(C(N)=O)nn2-c2ccc(S(N)(=O)=O)cc2)c1.
What is the InChIKey of 5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide?
The InChIKey is MLSAETQBYZOHGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O3S2/c1-9-6-14(23-8-9)13-7-12(15(16)20)18-19(13)10-2-4-11(5-3-10)24(17,21)22/h2-8H,1H3,(H2,16,20)(H2,17,21,22).
What are the key properties of 5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide?
5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide has a molecular weight of 362.44 g/mol, XLogP of 1.66, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylthiophen-2-yl)-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide is sourced from PubChem (CID 22315657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).