2-methyl-4-(methylamino)benzenesulfonamide

C8H12N2O2S — CID 71282580

IUPAC2-methyl-4-(methylamino)benzenesulfonamide
SMILESCNc1ccc(S(N)(=O)=O)c(C)c1
InChIInChI=1S/C8H12N2O2S/c1-6-5-7(10-2)3-4-8(6)13(9,11)12/h3-5,10H,1-2H3,(H2,9,11,12)
InChIKeyFGXPXPPZPBUJGD-UHFFFAOYSA-N
MW200.26 g/mol
LogP0.68
Rot. Bonds2

About 2-methyl-4-(methylamino)benzenesulfonamide

2-methyl-4-(methylamino)benzenesulfonamide (PubChem CID 71282580) has the molecular formula C8H12N2O2S and a molecular weight of 200.26 g/mol. Its IUPAC name is 2-methyl-4-(methylamino)benzenesulfonamide.

Molecular Properties

Compound Name2-methyl-4-(methylamino)benzenesulfonamide
PubChem CID71282580
Molecular FormulaC8H12N2O2S
Molecular Weight200.26 g/mol
Exact Mass200.06
IUPAC Name2-methyl-4-(methylamino)benzenesulfonamide
SMILESCNc1ccc(S(N)(=O)=O)c(C)c1
InChIInChI=1S/C8H12N2O2S/c1-6-5-7(10-2)3-4-8(6)13(9,11)12/h3-5,10H,1-2H3,(H2,9,11,12)
InChIKeyFGXPXPPZPBUJGD-UHFFFAOYSA-N
XLogP0.68
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.26
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-4-(propylsulfonylamino)benzenesulfonamide
CID 43134191
4-(benzenesulfonamido)-2-methylbenzenesulfonamide
CID 43246869
4-N,2-dimethylbenzene-1,4-disulfonamide
CID 162500455
2,4,5-trimethylbenzenesulfonamide
CID 961422
3,3,3-trifluoro-N-(3-methyl-4-sulfamoylphenyl)propanamide
CID 43246591
2,2-dimethyl-N-(3-methyl-4-sulfamoylphenyl)butanamide
CID 62677678
4-chloro-N-(3-methyl-4-sulfamoylphenyl)benzamide
CID 43246597
2-bromo-N-(3-methyl-4-sulfamoylphenyl)benzamide
CID 43134004
2-cyclopropyl-N-(3-methyl-4-sulfamoylphenyl)propanamide
CID 83154940
4-(2-ethoxyethylsulfonylamino)-2-methylbenzenesulfonamide
CID 63246113
N-(3-methyl-4-sulfamoylphenyl)oxane-4-sulfonamide
CID 62049563
4-methyl-2-(methylamino)benzenesulfonamide
CID 20558501

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(methylamino)benzenesulfonamide?
The IUPAC name of 2-methyl-4-(methylamino)benzenesulfonamide (CID 71282580) is 2-methyl-4-(methylamino)benzenesulfonamide.
What is the SMILES notation for 2-methyl-4-(methylamino)benzenesulfonamide?
The canonical SMILES for 2-methyl-4-(methylamino)benzenesulfonamide is CNc1ccc(S(N)(=O)=O)c(C)c1.
What is the InChIKey of 2-methyl-4-(methylamino)benzenesulfonamide?
The InChIKey is FGXPXPPZPBUJGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2S/c1-6-5-7(10-2)3-4-8(6)13(9,11)12/h3-5,10H,1-2H3,(H2,9,11,12).
What are the key properties of 2-methyl-4-(methylamino)benzenesulfonamide?
2-methyl-4-(methylamino)benzenesulfonamide has a molecular weight of 200.26 g/mol, XLogP of 0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(methylamino)benzenesulfonamide is sourced from PubChem (CID 71282580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).