1,3-dimethyl-N-phenylpyrazole-4-sulfonamide

C11H13N3O2S — CID 17377259

IUPAC1,3-dimethyl-N-phenylpyrazole-4-sulfonamide
SMILESCc1nn(C)cc1S(=O)(=O)Nc1ccccc1
InChIInChI=1S/C11H13N3O2S/c1-9-11(8-14(2)12-9)17(15,16)13-10-6-4-3-5-7-10/h3-8,13H,1-2H3
InChIKeyGEBUGCGAVLKMEL-UHFFFAOYSA-N
MW251.31 g/mol
LogP1.53
Rot. Bonds3

About 1,3-dimethyl-N-phenylpyrazole-4-sulfonamide

1,3-dimethyl-N-phenylpyrazole-4-sulfonamide (PubChem CID 17377259) has the molecular formula C11H13N3O2S and a molecular weight of 251.31 g/mol. Its IUPAC name is 1,3-dimethyl-N-phenylpyrazole-4-sulfonamide.

Molecular Properties

Compound Name1,3-dimethyl-N-phenylpyrazole-4-sulfonamide
PubChem CID17377259
Molecular FormulaC11H13N3O2S
Molecular Weight251.31 g/mol
Exact Mass251.07
IUPAC Name1,3-dimethyl-N-phenylpyrazole-4-sulfonamide
SMILESCc1nn(C)cc1S(=O)(=O)Nc1ccccc1
InChIInChI=1S/C11H13N3O2S/c1-9-11(8-14(2)12-9)17(15,16)13-10-6-4-3-5-7-10/h3-8,13H,1-2H3
InChIKeyGEBUGCGAVLKMEL-UHFFFAOYSA-N
XLogP1.53
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1,3-dimethyl-N-phenylpyrazole-4-sulfonamide 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

N-(4-ethylphenyl)-1,3-dimethylpyrazole-4-sulfonamide
CID 22773854
1,3-dimethyl-N-(4-sulfamoylphenyl)pyrazole-4-sulfonamide
CID 22774819
N-[4-(tert-butylsulfamoyl)phenyl]-1,3-dimethylpyrazole-4-sulfonamide
CID 17383073
1,3-dimethyl-N-pyridin-2-ylpyrazole-4-sulfonamide
CID 17375852
N-[4-(ethylsulfamoyl)phenyl]-1,3-dimethylpyrazole-4-sulfonamide
CID 22203398
N-[4-(4-fluorophenoxy)phenyl]-1,3-dimethylpyrazole-4-sulfonamide
CID 16676255
N-(1-benzyl-3,5-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole-4-sulfonamide
CID 22202446
2-[(1,3-dimethylpyrazol-4-yl)sulfonylamino]benzamide
CID 17371559
1,3-dimethyl-N-(3-morpholin-4-ylsulfonylphenyl)pyrazole-4-sulfonamide
CID 22203328
N-(2-methoxy-5-phenylphenyl)-1,3-dimethylpyrazole-4-sulfonamide
CID 16677699
N-(4-fluorophenyl)-1-methyl-3-phenylpyrazole-4-sulfonamide
CID 42345556
N-[4-(1-adamantylsulfamoyl)phenyl]-1,3-dimethylpyrazole-4-sulfonamide
CID 22202889

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-N-phenylpyrazole-4-sulfonamide?
The IUPAC name of 1,3-dimethyl-N-phenylpyrazole-4-sulfonamide (CID 17377259) is 1,3-dimethyl-N-phenylpyrazole-4-sulfonamide.
What is the SMILES notation for 1,3-dimethyl-N-phenylpyrazole-4-sulfonamide?
The canonical SMILES for 1,3-dimethyl-N-phenylpyrazole-4-sulfonamide is Cc1nn(C)cc1S(=O)(=O)Nc1ccccc1.
What is the InChIKey of 1,3-dimethyl-N-phenylpyrazole-4-sulfonamide?
The InChIKey is GEBUGCGAVLKMEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2S/c1-9-11(8-14(2)12-9)17(15,16)13-10-6-4-3-5-7-10/h3-8,13H,1-2H3.
What are the key properties of 1,3-dimethyl-N-phenylpyrazole-4-sulfonamide?
1,3-dimethyl-N-phenylpyrazole-4-sulfonamide has a molecular weight of 251.31 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-N-phenylpyrazole-4-sulfonamide is sourced from PubChem (CID 17377259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).