5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide

C13H17N3O3S — CID 61273624

IUPAC5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide
SMILESCCCOc1cccc(NS(=O)(=O)c2cn[nH]c2C)c1
InChIInChI=1S/C13H17N3O3S/c1-3-7-19-12-6-4-5-11(8-12)16-20(17,18)13-9-14-15-10(13)2/h4-6,8-9,16H,3,7H2,1-2H3,(H,14,15)
InChIKeyUXLFWTQTSWZCFD-UHFFFAOYSA-N
MW295.36 g/mol
LogP2.31
Rot. Bonds6

About 5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide

5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide (PubChem CID 61273624) has the molecular formula C13H17N3O3S and a molecular weight of 295.36 g/mol. Its IUPAC name is 5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound Name5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide
PubChem CID61273624
Molecular FormulaC13H17N3O3S
Molecular Weight295.36 g/mol
Exact Mass295.10
IUPAC Name5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide
SMILESCCCOc1cccc(NS(=O)(=O)c2cn[nH]c2C)c1
InChIInChI=1S/C13H17N3O3S/c1-3-7-19-12-6-4-5-11(8-12)16-20(17,18)13-9-14-15-10(13)2/h4-6,8-9,16H,3,7H2,1-2H3,(H,14,15)
InChIKeyUXLFWTQTSWZCFD-UHFFFAOYSA-N
XLogP2.31
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.36
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-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

5-methyl-N-(2-propoxyphenyl)-1H-pyrazole-4-sulfonamide
CID 61248809
N-[3-[(dimethylamino)methyl]phenyl]-5-methyl-1H-pyrazole-4-sulfonamide
CID 61273424
N-[3-(benzenesulfonyl)phenyl]-5-methyl-1H-pyrazole-4-sulfonamide
CID 154848350
3-[(5-methyl-1H-pyrazol-4-yl)sulfonylamino]benzenecarbothioamide
CID 54930241
N-(4-ethoxy-3-fluorophenyl)-5-methyl-1H-pyrazole-4-sulfonamide
CID 115620973
N-(4-amino-3-methylphenyl)-5-methyl-1H-pyrazole-4-sulfonamide
CID 54944574
5-methyl-N-(4-pentylphenyl)-1H-pyrazole-4-sulfonamide
CID 61249293
2-chloro-N-(3-propoxyphenyl)ethanesulfonamide
CID 107651359
N-(1H-indazol-6-yl)-5-methyl-1H-pyrazole-4-sulfonamide
CID 61276176
N-[3-(2-methoxyethoxy)phenyl]-1H-pyrazole-4-sulfonamide
CID 47267959
5-[(3-propoxyphenyl)sulfamoyl]thiophene-3-carboxylic acid
CID 39843156
2-amino-N-(3-ethoxyphenyl)-4-methylbenzenesulfonamide
CID 61126103

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of 5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide (CID 61273624) is 5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for 5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for 5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide is CCCOc1cccc(NS(=O)(=O)c2cn[nH]c2C)c1.
What is the InChIKey of 5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide?
The InChIKey is UXLFWTQTSWZCFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3S/c1-3-7-19-12-6-4-5-11(8-12)16-20(17,18)13-9-14-15-10(13)2/h4-6,8-9,16H,3,7H2,1-2H3,(H,14,15).
What are the key properties of 5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide?
5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide has a molecular weight of 295.36 g/mol, XLogP of 2.31, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(3-propoxyphenyl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 61273624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).