2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide

C13H21NO2S — CID 6463266

IUPAC2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide
SMILESCc1cc(C)c(C)c(S(=O)(=O)NC(C)C)c1C
InChIInChI=1S/C13H21NO2S/c1-8(2)14-17(15,16)13-11(5)9(3)7-10(4)12(13)6/h7-8,14H,1-6H3
InChIKeyCEGPRJBGXUBALT-UHFFFAOYSA-N
MW255.38 g/mol
LogP2.61
Rot. Bonds3

About 2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide

2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide (PubChem CID 6463266) has the molecular formula C13H21NO2S and a molecular weight of 255.38 g/mol. Its IUPAC name is 2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide.

Molecular Properties

Compound Name2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide
PubChem CID6463266
Molecular FormulaC13H21NO2S
Molecular Weight255.38 g/mol
Exact Mass255.13
IUPAC Name2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide
SMILESCc1cc(C)c(C)c(S(=O)(=O)NC(C)C)c1C
InChIInChI=1S/C13H21NO2S/c1-8(2)14-17(15,16)13-11(5)9(3)7-10(4)12(13)6/h7-8,14H,1-6H3
InChIKeyCEGPRJBGXUBALT-UHFFFAOYSA-N
XLogP2.61
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.38
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide 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-bromo-2,5,6-trimethyl-N-propan-2-ylbenzenesulfonamide
CID 66486092
2,3,5,6-tetramethyl-N-(1-phenylethyl)benzenesulfonamide
CID 19680818
(2S)-3-methyl-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]butanoic acid;hydrate
CID 132776903
2,4,6-trimethyl-3-[methyl(methylsulfonyl)amino]-N-propan-2-ylbenzenesulfonamide
CID 16805338
2,3,5,6-tetramethyl-N-(1-thiophen-2-ylethyl)benzenesulfonamide
CID 43001325
3-amino-2,5,6-trimethyl-N-(3-methylbutan-2-yl)benzenesulfonamide
CID 106503730
3-hydroxy-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoic acid
CID 43238329
3-amino-2,6-dimethyl-N-propan-2-ylbenzenesulfonamide
CID 43256917
[3,5-dimethyl-4-(propan-2-ylsulfamoyl)phenyl]boronic acid
CID 91759493
3-amino-N-(1-cyclobutylethyl)-2,5,6-trimethylbenzenesulfonamide
CID 106505416
(2R)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]pentanoic acid
CID 104935403
3-chloro-6-methoxy-2,4-dimethyl-N-propan-2-ylbenzenesulfonamide
CID 110758505

Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide?
The IUPAC name of 2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide (CID 6463266) is 2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide.
What is the SMILES notation for 2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide?
The canonical SMILES for 2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide is Cc1cc(C)c(C)c(S(=O)(=O)NC(C)C)c1C.
What is the InChIKey of 2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide?
The InChIKey is CEGPRJBGXUBALT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2S/c1-8(2)14-17(15,16)13-11(5)9(3)7-10(4)12(13)6/h7-8,14H,1-6H3.
What are the key properties of 2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide?
2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide has a molecular weight of 255.38 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetramethyl-N-propan-2-ylbenzenesulfonamide is sourced from PubChem (CID 6463266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).