N-methyl-4-(methylamino)benzenesulfonamide

C8H12N2O2S — CID 15049669

IUPACN-methyl-4-(methylamino)benzenesulfonamide
SMILESCNc1ccc(S(=O)(=O)NC)cc1
InChIInChI=1S/C8H12N2O2S/c1-9-7-3-5-8(6-4-7)13(11,12)10-2/h3-6,9-10H,1-2H3
InChIKeySBVZTOKSHJIYBK-UHFFFAOYSA-N
MW200.26 g/mol
LogP0.64
Rot. Bonds3

About N-methyl-4-(methylamino)benzenesulfonamide

N-methyl-4-(methylamino)benzenesulfonamide (PubChem CID 15049669) has the molecular formula C8H12N2O2S and a molecular weight of 200.26 g/mol. Its IUPAC name is N-methyl-4-(methylamino)benzenesulfonamide.

Molecular Properties

Compound NameN-methyl-4-(methylamino)benzenesulfonamide
PubChem CID15049669
Molecular FormulaC8H12N2O2S
Molecular Weight200.26 g/mol
Exact Mass200.06
IUPAC NameN-methyl-4-(methylamino)benzenesulfonamide
SMILESCNc1ccc(S(=O)(=O)NC)cc1
InChIInChI=1S/C8H12N2O2S/c1-9-7-3-5-8(6-4-7)13(11,12)10-2/h3-6,9-10H,1-2H3
InChIKeySBVZTOKSHJIYBK-UHFFFAOYSA-N
XLogP0.64
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.26
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-ethylpentan-2-yl)-4-(methylamino)benzenesulfonamide
CID 63836615
potassium 4-chloro-N-methylbenzenesulfonamide
CID 21293199
N-methyl-4-(2-methylpropylamino)benzenesulfonamide
CID 43453809
2-methyl-N-[4-(methylsulfamoyl)phenyl]propanamide
CID 17069914
N-methyl-3-(methylamino)benzenesulfonamide
CID 63089854
4-(3-hydroxypropylamino)-N-methylbenzenesulfonamide
CID 43453851
N-methyl-4-(2,2,2-trifluoroethylamino)benzenesulfonamide
CID 43453835
4-N-(3,4-dimethylphenyl)-1-N-methylbenzene-1,4-disulfonamide
CID 46555814
4-(methylamino)-N-(3-methylpentan-3-yl)benzenesulfonamide
CID 106330291
4-formyl-N-methylbenzenesulfonamide
CID 14327177
potassium;4-chloro-N-methylbenzenesulfonamide;hydride
CID 173400421
N-(2,5-dichlorophenyl)-4-(methylamino)benzenesulfonamide
CID 43332038

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(methylamino)benzenesulfonamide?
The IUPAC name of N-methyl-4-(methylamino)benzenesulfonamide (CID 15049669) is N-methyl-4-(methylamino)benzenesulfonamide.
What is the SMILES notation for N-methyl-4-(methylamino)benzenesulfonamide?
The canonical SMILES for N-methyl-4-(methylamino)benzenesulfonamide is CNc1ccc(S(=O)(=O)NC)cc1.
What is the InChIKey of N-methyl-4-(methylamino)benzenesulfonamide?
The InChIKey is SBVZTOKSHJIYBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2S/c1-9-7-3-5-8(6-4-7)13(11,12)10-2/h3-6,9-10H,1-2H3.
What are the key properties of N-methyl-4-(methylamino)benzenesulfonamide?
N-methyl-4-(methylamino)benzenesulfonamide has a molecular weight of 200.26 g/mol, XLogP of 0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(methylamino)benzenesulfonamide is sourced from PubChem (CID 15049669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).