2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide

C11H13N3O4S — CID 2808273

IUPAC2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide
SMILESCOc1ccc(OC)c(S(=O)(=O)Nc2ccn[nH]2)c1
InChIInChI=1S/C11H13N3O4S/c1-17-8-3-4-9(18-2)10(7-8)19(15,16)14-11-5-6-12-13-11/h3-7H,1-2H3,(H2,12,13,14)
InChIKeyKSGGPCXNYACQNC-UHFFFAOYSA-N
MW283.31 g/mol
LogP1.23
Rot. Bonds5

About 2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide

2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide (PubChem CID 2808273) has the molecular formula C11H13N3O4S and a molecular weight of 283.31 g/mol. Its IUPAC name is 2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide.

Molecular Properties

Compound Name2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide
PubChem CID2808273
Molecular FormulaC11H13N3O4S
Molecular Weight283.31 g/mol
Exact Mass283.06
IUPAC Name2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide
SMILESCOc1ccc(OC)c(S(=O)(=O)Nc2ccn[nH]2)c1
InChIInChI=1S/C11H13N3O4S/c1-17-8-3-4-9(18-2)10(7-8)19(15,16)14-11-5-6-12-13-11/h3-7H,1-2H3,(H2,12,13,14)
InChIKeyKSGGPCXNYACQNC-UHFFFAOYSA-N
XLogP1.23
TPSA93.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide?
The IUPAC name of 2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide (CID 2808273) is 2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide.
What is the SMILES notation for 2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide?
The canonical SMILES for 2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide is COc1ccc(OC)c(S(=O)(=O)Nc2ccn[nH]2)c1.
What is the InChIKey of 2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide?
The InChIKey is KSGGPCXNYACQNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O4S/c1-17-8-3-4-9(18-2)10(7-8)19(15,16)14-11-5-6-12-13-11/h3-7H,1-2H3,(H2,12,13,14).
What are the key properties of 2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide?
2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide has a molecular weight of 283.31 g/mol, XLogP of 1.23, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethoxy-N-(1H-pyrazol-5-yl)benzenesulfonamide is sourced from PubChem (CID 2808273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).