chempirical

3-Amino-N,N-diethyl-4-methoxybenzenesulfonamide

C11H18N2O3SCAS 97-35-8258.34 g/mol

Open in Covalent MOL file
NSOOONH2
EtherPrimary amineSulfonamide

Properties

Molecular formula
C11H18N2O3S
Molar mass
258.34 g/mol
Exact mass
258.1038 Da
logP
1.31Crippen estimate
Polar surface area
72.6 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
5

Identifiers

CAS number
97-35-8
SMILES
CCN(CC)S(=O)(=O)c1ccc(OC)c(N)c1
InChIKey
WBGVVXSCGNGJFL-UHFFFAOYSA-N
InChI
InChI=1S/C11H18N2O3S/c1-4-13(5-2)17(14,15)9-6-7-11(16-3)10(12)8-9/h6-8H,4-5,12H2,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

16 names · show all
  • Benzenesulfonamide, 3-amino-N,N-diethyl-4-methoxy-
  • Metanilamide, N1,N1-diethyl-4-methoxy-
  • C.I. 37150
  • Brentamine fast red ITR base
  • Fast red ITR base
  • Orle base fast red ITR
  • 2-Methoxy-5-(diethylaminosulfonyl)aniline
  • Red ITR base
  • Fast red ITR
  • 2-Methoxy-5-(diethylsulfamoyl)aniline
  • 2-Methoxy-5-(N,N-diethylsulfamoyl)aniline
  • 3-Amino-1-[(diethylamino)sulfonyl]-4-methoxybenzene
  • NSC 50670
  • 2-Methoxy-5-(N,N-diethyl)sulfanilamide-aniline
  • N,N-Diethyl-3-amino-4-methoxybenzenesulfonamide
  • 3-Amino-N,N-diethyl-4-methoxybenzene-1-sulfonamide

Work with 3-Amino-N,N-diethyl-4-methoxybenzenesulfonamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Aminoanisole-4-sulfonic acid98-42-059 % similar 3-Amino-4-methoxybenzenesulfonyl fluoride498-74-855 % similar 2,4-Diaminoanisole sulfate39156-41-743 % similar 2,5-Dimethoxyaniline102-56-743 % similar 2,4-Diaminoanisole615-05-443 % similar Para-cresidine120-71-841 % similar 1,3-Benzenediamine, 4-methoxy-, sulfate, hydrate (1:1:?)123333-56-241 % similar 5-Chloro-2-methoxyaniline95-03-440 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook