N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide

C11H13N3O3S — CID 81241328

IUPACN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide
SMILESCc1n[nH]c(C)c1NS(=O)(=O)c1ccccc1O
InChIInChI=1S/C11H13N3O3S/c1-7-11(8(2)13-12-7)14-18(16,17)10-6-4-3-5-9(10)15/h3-6,14-15H,1-2H3,(H,12,13)
InChIKeyJHSGETUEOTZYMA-UHFFFAOYSA-N
MW267.31 g/mol
LogP1.53
Rot. Bonds3

About N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide

N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide (PubChem CID 81241328) has the molecular formula C11H13N3O3S and a molecular weight of 267.31 g/mol. Its IUPAC name is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide
PubChem CID81241328
Molecular FormulaC11H13N3O3S
Molecular Weight267.31 g/mol
Exact Mass267.07
IUPAC NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide
SMILESCc1n[nH]c(C)c1NS(=O)(=O)c1ccccc1O
InChIInChI=1S/C11H13N3O3S/c1-7-11(8(2)13-12-7)14-18(16,17)10-6-4-3-5-9(10)15/h3-6,14-15H,1-2H3,(H,12,13)
InChIKeyJHSGETUEOTZYMA-UHFFFAOYSA-N
XLogP1.53
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 51.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-nitrobenzenesulfonamide
CID 43547583
2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)pyridine-3-sulfonamide
CID 62145923
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(methylamino)pyridine-3-sulfonamide
CID 62147866
N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-fluoro-2-methylbenzenesulfonamide
CID 43547468
4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)benzenesulfonamide
CID 25046851
methyl 3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfamoyl]thiophene-2-carboxylate
CID 43547547
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide
CID 43547502
N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-(1-hydroxyethyl)benzenesulfonamide
CID 43547799
3-chloro-N-(3,5-dimethyl-1H-pyrazol-4-yl)benzenesulfonamide
CID 43547574
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-nitrophenyl)sulfonylamino]benzamide
CID 21369135
5-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfamoyl]thiophene-2-carbothioamide
CID 106270396
4-chloro-N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methoxybenzenesulfonamide
CID 43547505

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide?
The IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide (CID 81241328) is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide.
What is the SMILES notation for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide?
The canonical SMILES for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide is Cc1n[nH]c(C)c1NS(=O)(=O)c1ccccc1O.
What is the InChIKey of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide?
The InChIKey is JHSGETUEOTZYMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O3S/c1-7-11(8(2)13-12-7)14-18(16,17)10-6-4-3-5-9(10)15/h3-6,14-15H,1-2H3,(H,12,13).
What are the key properties of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide?
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide has a molecular weight of 267.31 g/mol, XLogP of 1.53, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxybenzenesulfonamide is sourced from PubChem (CID 81241328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).