chempirical

Dapoxetine

C21H23NOCAS 119356-77-3305.42 g/mol

Open in Covalent MOL file
NO
EtherTertiary amine

Properties

Molecular formula
C21H23NO
Molar mass
305.42 g/mol
Exact mass
305.1780 Da
logP
4.91Crippen estimate
Polar surface area
12.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
6
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
119356-77-3
SMILES
CN(C)[C@@H](CCOc1cccc2ccccc12)c1ccccc1
InChIKey
USRHYDPUVLEVMC-FQEVSTJZSA-N
InChI
InChI=1S/C21H23NO/c1-22(2)20(18-10-4-3-5-11-18)15-16-23-21-14-8-12-17-9-6-7-13-19(17)21/h3-14,20H,15-16H2,1-2H3/t20-/m0/s1

Weigh it out

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

Names and synonyms

8 names
  • Benzenemethanamine, N,N-dimethyl-α-[2-(1-naphthalenyloxy)ethyl]-, (αS)-
  • Benzenemethanamine, N,N-dimethyl-α-[2-(1-naphthalenyloxy)ethyl]-, (S)-
  • (αS)-N,N-Dimethyl-α-[2-(1-naphthalenyloxy)ethyl]benzenemethanamine
  • LY 210448
  • (S)-(+)-Dapoxetine
  • (S)-(+)-N,N-Dimethyl-α-[2-(1-naphthalenyloxy)ethyl]benzenemethanamine
  • (S)-(+)-N,N-Dimethyl-3-(naphthalen-1-yloxy)-1-phenylpropan-1-amine
  • (1S)-N,N-Dimethyl-3-naphthalen-1-yloxy-1-phenylpropan-1-amine

Work with Dapoxetine

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

Dapoxetine hydrochloride129938-20-192 % similar 1-Ethoxynaphthalene5328-01-850 % similar 2-[(1-Naphthalenyloxy)methyl]oxirane2461-42-943 % similar 1-Methoxynaphthalene2216-69-539 % similar (S)-(+)-N,N-Dimethyl-3-(1-naphthalenyloxy)-3-(2-thienyl)propanamine132335-46-738 % similar Propranolol525-66-638 % similar Naphthoxyacetic acid2976-75-238 % similar Naftopidil57149-07-237 % similar

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

Elsewhere

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