(±)-Nefopam hydrochloride

C17H20ClNOCAS 23327-57-3289.80 g/mol

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NOHCl
EtherTertiary amine

Properties

Molecular formula
C17H20ClNO
Molar mass
289.80 g/mol
Exact mass
289.1233 Da
Melting point
238–242 °C
logP
3.66Crippen estimate
Polar surface area
12.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
23327-57-3
SMILES
CN1CCOC(c2ccccc2)c2ccccc2C1.Cl
InChIKey
CNNVSINJDJNHQK-UHFFFAOYSA-N
InChI
InChI=1S/C17H19NO.ClH/c1-18-11-12-19-17(14-7-3-2-4-8-14)16-10-6-5-9-15(16)13-18;/h2-10,17H,11-13H2,1H3;1H

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Names and synonyms

8 names
  • 1H-2,5-Benzoxazocine, 3,4,5,6-tetrahydro-5-methyl-1-phenyl-, hydrochloride (1:1)
  • 1H-2,5-Benzoxazocine, 3,4,5,6-tetrahydro-5-methyl-1-phenyl-, hydrochloride
  • Fenazoxine
  • Fenazoxine hydrochloride
  • Nefopam hydrochloride
  • R 738
  • Ajan
  • Acupan

Work with (±)-Nefopam 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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Nefopam13669-70-0Free base

Similar compounds

Orphenadrine hydrochloride341-69-557 % similar Diphenhydramine hydrochloride147-24-057 % similar Diphenhydramine58-73-150 % similar Diafen132-18-348 % similar Cloperastine hydrochloride14984-68-042 % similar Cyclizine hydrochloride303-25-342 % similar Orphenadrine citrate4682-36-438 % similar Vanoxerine dihydrochloride67469-78-738 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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