chempirical

Tesmilifene

C19H25NOCAS 98774-23-3283.42 g/mol

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NO
EtherTertiary amine

Properties

Molecular formula
C19H25NO
Molar mass
283.42 g/mol
Exact mass
283.1936 Da
logP
4.00Crippen estimate
Polar surface area
12.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
8

Identifiers

CAS number
98774-23-3
SMILES
CCN(CC)CCOc1ccc(Cc2ccccc2)cc1
InChIKey
NFIXBCVWIPOYCD-UHFFFAOYSA-N
InChI
InChI=1S/C19H25NO/c1-3-20(4-2)14-15-21-19-12-10-18(11-13-19)16-17-8-6-5-7-9-17/h5-13H,3-4,14-16H2,1-2H3

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Names and synonyms

6 names
  • Ethanamine, N,N-diethyl-2-[4-(phenylmethyl)phenoxy]-
  • Triethylamine, 2-(α-phenyl-p-tolyloxy)-
  • N,N-Diethyl-2-[4-(phenylmethyl)phenoxy]ethanamine
  • N,N-Diethyl-2-(p-benzylphenoxy)ethylamine
  • DPPE
  • 2-(4-Benzylphenoxy)-N,N-diethylethanamine

Work with Tesmilifene

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

Enclomiphene15690-57-058 % similar Clomiphene911-45-558 % similar Tilorone hydrochloride27591-69-144 % similar Clostilbegit50-41-941 % similar Enclomiphene citrate7599-79-341 % similar 4-[2-(Dimethylamino)ethoxy]benzenemethanamine20059-73-840 % similar Ethyl phenyl ether103-73-140 % similar N-(2-(4-Chloromethylphenoxy)ethyl)hexahydro-1H-azepine hydrochloride223251-25-040 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook