2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid

C11H11N3O5S — CID 61394386

IUPAC2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid
SMILESCOc1ccc(S(=O)(=O)Nc2ccn[nH]2)cc1C(=O)O
InChIInChI=1S/C11H11N3O5S/c1-19-9-3-2-7(6-8(9)11(15)16)20(17,18)14-10-4-5-12-13-10/h2-6H,1H3,(H,15,16)(H2,12,13,14)
InChIKeyJELHVWXHSNJKST-UHFFFAOYSA-N
MW297.29 g/mol
LogP0.92
Rot. Bonds5

About 2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid

2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid (PubChem CID 61394386) has the molecular formula C11H11N3O5S and a molecular weight of 297.29 g/mol. Its IUPAC name is 2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid.

Molecular Properties

Compound Name2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid
PubChem CID61394386
Molecular FormulaC11H11N3O5S
Molecular Weight297.29 g/mol
Exact Mass297.04
IUPAC Name2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid
SMILESCOc1ccc(S(=O)(=O)Nc2ccn[nH]2)cc1C(=O)O
InChIInChI=1S/C11H11N3O5S/c1-19-9-3-2-7(6-8(9)11(15)16)20(17,18)14-10-4-5-12-13-10/h2-6H,1H3,(H,15,16)(H2,12,13,14)
InChIKeyJELHVWXHSNJKST-UHFFFAOYSA-N
XLogP0.92
TPSA121.38 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.29
LogP ≤ 50.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid with MolForge

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

Launch Full Analysis

Related Compounds

3,4-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide
CID 61394362
2-methoxy-5-(pyrimidin-2-ylsulfamoyl)benzoic acid
CID 43323984
4-amino-3-methoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide
CID 81437806
5-(1H-imidazol-2-ylsulfamoyl)-2-methoxybenzoic acid
CID 63565237
2-methoxy-5-(1,2,4-triazin-3-ylsulfamoyl)benzoic acid
CID 114387105
5-bromo-2-methoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide
CID 56684268
5-[(2,5-difluorophenyl)sulfamoyl]-2-methoxybenzoic acid
CID 56812265
3-methyl-4-propan-2-yloxy-N-(1H-pyrazol-5-yl)benzenesulfonamide
CID 61394212
5-[(2-fluorophenyl)sulfamoyl]-2-methoxybenzoic acid
CID 56812258
5-[(5-bromo-1,3-thiazol-2-yl)sulfamoyl]-2-methoxybenzoic acid
CID 60784641
5-[(3-chloro-2-methoxyphenyl)sulfamoyl]-2-methoxybenzoic acid
CID 56798970
2-methoxy-5-(piperidin-1-ylsulfamoyl)benzoic acid
CID 83005779

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid?
The IUPAC name of 2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid (CID 61394386) is 2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid.
What is the SMILES notation for 2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid?
The canonical SMILES for 2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid is COc1ccc(S(=O)(=O)Nc2ccn[nH]2)cc1C(=O)O.
What is the InChIKey of 2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid?
The InChIKey is JELHVWXHSNJKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O5S/c1-19-9-3-2-7(6-8(9)11(15)16)20(17,18)14-10-4-5-12-13-10/h2-6H,1H3,(H,15,16)(H2,12,13,14).
What are the key properties of 2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid?
2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid has a molecular weight of 297.29 g/mol, XLogP of 0.92, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-(1H-pyrazol-5-ylsulfamoyl)benzoic acid is sourced from PubChem (CID 61394386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).