chempirical

Metoprolol

C15H25NO3CAS 37350-58-6267.37 g/mol

Open in Covalent MOL file
OOOHNH
AlcoholEtherSecondary amine

Properties

Molecular formula
C15H25NO3
Molar mass
267.37 g/mol
Exact mass
267.1834 Da
Melting point
35 °C
logP
1.61Crippen estimate
Polar surface area
50.7 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
9

Identifiers

CAS number
37350-58-6
SMILES
COCCc1ccc(OCC(O)CNC(C)C)cc1
InChIKey
IUBSYMUCCVWXPE-UHFFFAOYSA-N
InChI
InChI=1S/C15H25NO3/c1-12(2)16-10-14(17)11-19-15-6-4-13(5-7-15)8-9-18-3/h4-7,12,14,16-17H,8-11H2,1-3H3

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

Names and synonyms

16 names · show all
  • 2-Propanol, 1-[4-(2-methoxyethyl)phenoxy]-3-[(1-methylethyl)amino]-
  • 1-[4-(2-Methoxyethyl)phenoxy]-3-[(1-methylethyl)amino]-2-propanol
  • 1-Isopropylamino-3-[4-(2-methoxyethyl)phenoxy]-2-propanol
  • CGP 2175
  • (±)-Metoprolol
  • Dl-Metoprolol
  • (RS)-Metoprolol
  • Spesicor
  • Beatrolol
  • Seroken
  • Meijoprolol
  • Toprol
  • Metocard
  • Vazocardin
  • [2-Hydroxy-3-[4-(2-methoxyethyl)phenoxy]propyl](propan-2-yl)amine
  • 1-[4-(2-Methoxyethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol

Work with Metoprolol

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

Metoprolol succinate98418-47-480 % similar Metoprolol tartrate56392-17-779 % similar Betaxolol63659-18-771 % similar Levobetaxolol hcl116209-55-367 % similar Betaxolol hydrochloride63659-19-867 % similar Esmolol81147-92-467 % similar Bisoprolol66722-44-963 % similar Esmolol hydrochloride81161-17-363 % similar

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

Same formula

1,1-Dimethylethyl 9-oxo-3-azaspiro[5.5]undecane-3-carboxylate873924-08-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook