(S)-(+)-N,N-Dimethyl-3-(1-naphthalenyloxy)-3-(2-thienyl)propanamine

C19H21NOSCAS 132335-46-7311.44 g/mol

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NOS
EtherTertiary amine

Properties

Molecular formula
C19H21NOS
Molar mass
311.44 g/mol
Exact mass
311.1344 Da
logP
4.97Crippen estimate
Polar surface area
12.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
6
Stereocentres
Sin SMILES atom order

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
132335-46-7
SMILES
CN(C)CC[C@H](Oc1cccc2ccccc12)c1cccs1
InChIKey
JFTURWWGPMTABQ-SFHVURJKSA-N
InChI
InChI=1S/C19H21NOS/c1-20(2)13-12-18(19-11-6-14-22-19)21-17-10-5-8-15-7-3-4-9-16(15)17/h3-11,14,18H,12-13H2,1-2H3/t18-/m0/s1

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

Names and synonyms

5 names
  • 2-Thiophenepropanamine, N,N-dimethyl-γ-(1-naphthalenyloxy)-, (γS)-
  • 2-Thiophenepropanamine, N,N-dimethyl-γ-(1-naphthalenyloxy)-, (S)-
  • (γS)-N,N-Dimethyl-γ-(1-naphthalenyloxy)-2-thiophenepropanamine
  • (+)-N-Methylduloxetine
  • (S)-N,N-Dimethyl-3-(1-naphthalenoxy)-3-(2-thienyl)propanamine

Work with (S)-(+)-N,N-Dimethyl-3-(1-naphthalenyloxy)-3-(2-thienyl)propanamine

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.

(S)-(+)-N,N-Dimethyl-3-(1-naphthalenyloxy)-3-(2-thienyl)propanamine oxalate132335-47-8Salt

Similar compounds

Duloxetine116539-59-469 % similar (R)-Duloxetine116539-60-769 % similar Duloxetine hydrochloride136434-34-965 % similar (S)-N,N-Dimethyl-3-(2-thienyl)-3-hydroxypropanamine132335-44-547 % similar N,N-Dimethyl-3-(2-thienyl)-3-hydroxypropanamine13636-02-747 % similar 1-Ethoxynaphthalene5328-01-839 % similar Dapoxetine119356-77-338 % similar Napropamide15299-99-737 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Isothiocyanato-1,3-bis(1-methylethyl)-5-phenoxybenzene80058-93-1

Elsewhere

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