N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide

C15H15N3O2S — CID 62686396

IUPACN-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide
SMILESCc1ccc(C)c(S(=O)(=O)Nc2n[nH]c3ccccc23)c1
InChIInChI=1S/C15H15N3O2S/c1-10-7-8-11(2)14(9-10)21(19,20)18-15-12-5-3-4-6-13(12)16-17-15/h3-9H,1-2H3,(H2,16,17,18)
InChIKeyDUJRIWGPOSRRHH-UHFFFAOYSA-N
MW301.37 g/mol
LogP2.98
Rot. Bonds3

About N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide

N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide (PubChem CID 62686396) has the molecular formula C15H15N3O2S and a molecular weight of 301.37 g/mol. Its IUPAC name is N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide.

Molecular Properties

Compound NameN-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide
PubChem CID62686396
Molecular FormulaC15H15N3O2S
Molecular Weight301.37 g/mol
Exact Mass301.09
IUPAC NameN-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide
SMILESCc1ccc(C)c(S(=O)(=O)Nc2n[nH]c3ccccc23)c1
InChIInChI=1S/C15H15N3O2S/c1-10-7-8-11(2)14(9-10)21(19,20)18-15-12-5-3-4-6-13(12)16-17-15/h3-9H,1-2H3,(H2,16,17,18)
InChIKeyDUJRIWGPOSRRHH-UHFFFAOYSA-N
XLogP2.98
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide 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

3,5-dichloro-N-(1H-indazol-3-yl)benzenesulfonamide
CID 62686764
2,5-dimethyl-N-(3-methyl-2-pyridinyl)benzenesulfonamide
CID 15944002
3-chloro-N-(1H-indazol-3-yl)benzenesulfonamide
CID 62686573
2,6-dichloro-N-(1H-indazol-3-yl)benzenesulfonamide
CID 62686222
N-(2,6-dimethylphenyl)-2,5-dimethylbenzenesulfonamide
CID 8504690
3-bromo-4-chloro-N-(1H-indazol-3-yl)benzenesulfonamide
CID 106606417
N-[3-(3,5-dimethylanilino)quinoxalin-2-yl]-2,5-dimethylbenzenesulfonamide
CID 1400516
2,5-dimethyl-N-(1H-1,2,4-triazol-5-yl)benzenesulfonamide
CID 55153733
2,5-dimethyl-N-(4-phenylphenyl)benzenesulfonamide
CID 925055
2,5-dimethyl-N-[2-(trifluoromethyl)phenyl]benzenesulfonamide
CID 22774165
N-benzo[h]quinolin-4-yl-2,5-dimethylbenzenesulfonamide
CID 46308022
N-(3-methoxy-1H-1,2,4-triazol-5-yl)-2,5-dimethylbenzenesulfonamide
CID 83093255

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide?
The IUPAC name of N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide (CID 62686396) is N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide.
What is the SMILES notation for N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide?
The canonical SMILES for N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide is Cc1ccc(C)c(S(=O)(=O)Nc2n[nH]c3ccccc23)c1.
What is the InChIKey of N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide?
The InChIKey is DUJRIWGPOSRRHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S/c1-10-7-8-11(2)14(9-10)21(19,20)18-15-12-5-3-4-6-13(12)16-17-15/h3-9H,1-2H3,(H2,16,17,18).
What are the key properties of N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide?
N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide has a molecular weight of 301.37 g/mol, XLogP of 2.98, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-3-yl)-2,5-dimethylbenzenesulfonamide is sourced from PubChem (CID 62686396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).