chempirical

N-Methyl-3-(1-methyl-4-piperidinyl)-1H-indole-5-ethanesulfonamide hydrochloride

C17H26ClN3O2SCAS 143388-64-1371.92 g/mol

Open in Covalent MOL file
NHSOONHNHCl
SulfonamideTertiary amine

Properties

Molecular formula
C17H26ClN3O2S
Molar mass
371.92 g/mol
Exact mass
371.1434 Da
logP
2.49Crippen estimate
Polar surface area
65.2 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
5

Identifiers

CAS number
143388-64-1
SMILES
CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1.Cl
InChIKey
AWEZYKMQFAUBTD-UHFFFAOYSA-N
InChI
InChI=1S/C17H25N3O2S.ClH/c1-18-23(21,22)10-7-13-3-4-17-15(11-13)16(12-19-17)14-5-8-20(2)9-6-14;/h3-4,11-12,14,18-19H,5-10H2,1-2H3;1H

Weigh it out

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

Names and synonyms

7 names
  • 1H-Indole-5-ethanesulfonamide, N-methyl-3-(1-methyl-4-piperidinyl)-, hydrochloride (1:1)
  • 1H-Indole-5-ethanesulfonamide, N-methyl-3-(1-methyl-4-piperidinyl)-, monohydrochloride
  • GR 85548A
  • Naratriptan hydrochloride
  • Amerge
  • Naramig
  • Naratrex 1

Work with N-Methyl-3-(1-methyl-4-piperidinyl)-1H-indole-5-ethanesulfonamide hydrochloride

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

Naratriptan121679-13-894 % similar 3-(1-Methyl-4-piperidinyl)-1H-indol-5-ol57477-39-151 % similar Sumatriptan103628-46-248 % similar 3-(2-Aminoethyl)-N-methyl-1H-indole-5-methanesulfonamide88919-22-643 % similar Sumatriptan succinate103628-48-442 % similar Eletriptan143322-58-138 % similar Eletriptan hydrobromide177834-92-336 % similar Almotriptan154323-57-634 % similar

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

Elsewhere

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