4-methyl-2-(methylamino)benzenesulfonamide

C8H12N2O2S — CID 20558501

IUPAC4-methyl-2-(methylamino)benzenesulfonamide
SMILESCNc1cc(C)ccc1S(N)(=O)=O
InChIInChI=1S/C8H12N2O2S/c1-6-3-4-8(13(9,11)12)7(5-6)10-2/h3-5,10H,1-2H3,(H2,9,11,12)
InChIKeyZSTWWDZALWUIEV-UHFFFAOYSA-N
MW200.26 g/mol
LogP0.68
Rot. Bonds2

About 4-methyl-2-(methylamino)benzenesulfonamide

4-methyl-2-(methylamino)benzenesulfonamide (PubChem CID 20558501) has the molecular formula C8H12N2O2S and a molecular weight of 200.26 g/mol. Its IUPAC name is 4-methyl-2-(methylamino)benzenesulfonamide.

Molecular Properties

Compound Name4-methyl-2-(methylamino)benzenesulfonamide
PubChem CID20558501
Molecular FormulaC8H12N2O2S
Molecular Weight200.26 g/mol
Exact Mass200.06
IUPAC Name4-methyl-2-(methylamino)benzenesulfonamide
SMILESCNc1cc(C)ccc1S(N)(=O)=O
InChIInChI=1S/C8H12N2O2S/c1-6-3-4-8(13(9,11)12)7(5-6)10-2/h3-5,10H,1-2H3,(H2,9,11,12)
InChIKeyZSTWWDZALWUIEV-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-(methylamino)-4-nitrobenzenesulfonamide
CID 62144576
2-methyl-4-(methylamino)benzenesulfonamide
CID 71282580
4-methyl-2-N-(methylsulfamoyl)benzene-1,2-diamine
CID 114804948
2-(2-hydroxyethyl)-4-methylbenzenesulfonamide
CID 67168218
2-[2-(methanesulfonamido)ethyl]-4-methylbenzenesulfonamide
CID 67901778
5-chloro-2-(methylamino)benzenesulfonamide
CID 44590431
5-amino-3-(2,5-dimethylanilino)-2-methylbenzenesulfonamide
CID 79899513
2-hydrazinyl-N,5-dimethylaniline
CID 149056718
2-but-3-enyl-4-methylbenzenesulfonamide
CID 175817922
2-amino-3-(2-bromo-5-methylanilino)benzenesulfonamide
CID 115992915
7-(methylamino)-2,1,3-benzoxadiazole-4-sulfonamide
CID 10656936
N,N,5-trimethyl-2-sulfamoylbenzamide
CID 65456580

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(methylamino)benzenesulfonamide?
The IUPAC name of 4-methyl-2-(methylamino)benzenesulfonamide (CID 20558501) is 4-methyl-2-(methylamino)benzenesulfonamide.
What is the SMILES notation for 4-methyl-2-(methylamino)benzenesulfonamide?
The canonical SMILES for 4-methyl-2-(methylamino)benzenesulfonamide is CNc1cc(C)ccc1S(N)(=O)=O.
What is the InChIKey of 4-methyl-2-(methylamino)benzenesulfonamide?
The InChIKey is ZSTWWDZALWUIEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2S/c1-6-3-4-8(13(9,11)12)7(5-6)10-2/h3-5,10H,1-2H3,(H2,9,11,12).
What are the key properties of 4-methyl-2-(methylamino)benzenesulfonamide?
4-methyl-2-(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 4-methyl-2-(methylamino)benzenesulfonamide is sourced from PubChem (CID 20558501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).