chempirical

Hordenine

C10H15NOCAS 539-15-1165.24 g/mol

Open in Covalent MOL file
NOH
PhenolTertiary amine

Properties

Molecular formula
C10H15NO
Molar mass
165.24 g/mol
Exact mass
165.1154 Da
Density
1.12 g/mL
Melting point
117.5 °C
Boiling point
136–137 °C (at 13 Torr)
logP
1.50Crippen estimate
Polar surface area
23.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
3

Identifiers

CAS number
539-15-1
SMILES
CN(C)CCc1ccc(O)cc1
InChIKey
KUBCEEMXQZUPDQ-UHFFFAOYSA-N
InChI
InChI=1S/C10H15NO/c1-11(2)8-7-9-3-5-10(12)6-4-9/h3-6,12H,7-8H2,1-2H3

Weigh it out

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

Names and synonyms

15 names · show all
  • Phenol, 4-[2-(dimethylamino)ethyl]-
  • Eremursine
  • Phenol, p-[2-(dimethylamino)ethyl]-
  • 4-[2-(Dimethylamino)ethyl]phenol
  • Anhaline
  • p-Hydroxy-N,N-dimethylphenethylamine
  • Peyocactine
  • N,N-Dimethyl-p-hydroxyphenethylamine
  • p-[2-(Dimethylamino)ethyl]phenol
  • N,N-Dimethyltyramine
  • Anhalin
  • Ordenina
  • Hordenin
  • Cactine
  • N,N-Dimethyl-4-hydroxy-β-phenethylamine

Work with Hordenine

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

Hordenine hydrochloride6027-23-288 % similar Hordenine sulfate622-64-073 % similar 4-Propylphenol645-56-752 % similar N,N-Dimethylphenethylamine hydrochloride10275-21-552 % similar 4-Butylphenol1638-22-848 % similar 4-Ethylphenol123-07-948 % similar Tyrosol501-94-048 % similar Bisphenol F620-92-848 % similar

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

Same formula

N-Benzyl-N-methylethanolamine101-98-4 3-[1-(Dimethylamino)ethyl]phenol105601-04-5 2-Amino-4-tert-butylphenol1199-46-8 (S)-3-[1-(Dimethylamino)ethyl]phenol139306-10-8 N-Methyl-N-(2-hydroxyethyl)-P-toluidine2842-44-6 Ephedrine299-42-3 Perillartine30950-27-7 (-)-Pseudoephedrine321-97-1

Elsewhere

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