2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide

C10H17N3O4S2 — CID 106342257

IUPAC2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide
SMILESCNc1ccccc1S(=O)(=O)NCCS(=O)(=O)NC
InChIInChI=1S/C10H17N3O4S2/c1-11-9-5-3-4-6-10(9)19(16,17)13-7-8-18(14,15)12-2/h3-6,11-13H,7-8H2,1-2H3
InChIKeyTUKROKQCKWFQQI-UHFFFAOYSA-N
MW307.40 g/mol
LogP-0.44
Rot. Bonds7

About 2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide

2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide (PubChem CID 106342257) has the molecular formula C10H17N3O4S2 and a molecular weight of 307.40 g/mol. Its IUPAC name is 2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide
PubChem CID106342257
Molecular FormulaC10H17N3O4S2
Molecular Weight307.40 g/mol
Exact Mass307.07
IUPAC Name2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide
SMILESCNc1ccccc1S(=O)(=O)NCCS(=O)(=O)NC
InChIInChI=1S/C10H17N3O4S2/c1-11-9-5-3-4-6-10(9)19(16,17)13-7-8-18(14,15)12-2/h3-6,11-13H,7-8H2,1-2H3
InChIKeyTUKROKQCKWFQQI-UHFFFAOYSA-N
XLogP-0.44
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 5-0.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-bromo-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide
CID 102675926
2-(methylamino)-N-(4,4,4-trifluorobutyl)benzenesulfonamide
CID 115522029
2-(methylamino)-N-(3-phenylpropyl)benzenesulfonamide
CID 62145986
N-[2-[[2-(methylamino)phenyl]sulfonylamino]ethyl]acetamide
CID 55043683
2-(methylamino)-N-[2-[methyl(propan-2-yl)amino]ethyl]benzenesulfonamide
CID 62640214
2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzamide
CID 114175674
2-(methylamino)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]benzenesulfonamide
CID 106049676
5-amino-2-fluoro-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide
CID 106333323
4-bromo-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide
CID 110292936
N-[(4-ethylcyclohexyl)methyl]-2-(methylamino)benzenesulfonamide
CID 62152226
2-amino-5-bromo-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide
CID 106333410
5-amino-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-4-sulfonamide
CID 114174781

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide?
The IUPAC name of 2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide (CID 106342257) is 2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide.
What is the SMILES notation for 2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide?
The canonical SMILES for 2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide is CNc1ccccc1S(=O)(=O)NCCS(=O)(=O)NC.
What is the InChIKey of 2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide?
The InChIKey is TUKROKQCKWFQQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O4S2/c1-11-9-5-3-4-6-10(9)19(16,17)13-7-8-18(14,15)12-2/h3-6,11-13H,7-8H2,1-2H3.
What are the key properties of 2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide?
2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide has a molecular weight of 307.40 g/mol, XLogP of -0.44, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzenesulfonamide is sourced from PubChem (CID 106342257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).