chempirical

Alprenolol

C15H23NO2CAS 13655-52-2249.35 g/mol

Open in Covalent MOL file
OOHNH
AlcoholAlkeneEtherSecondary amine

Properties

Molecular formula
C15H23NO2
Molar mass
249.35 g/mol
Exact mass
249.1729 Da
Melting point
107–109 °C
pKa
9.51
logP
2.15Crippen estimate
Polar surface area
41.5 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
8

Identifiers

CAS number
13655-52-2
SMILES
C=CCc1ccccc1OCC(O)CNC(C)C
InChIKey
PAZJSJFMUHDSTF-UHFFFAOYSA-N
InChI
InChI=1S/C15H23NO2/c1-4-7-13-8-5-6-9-15(13)18-11-14(17)10-16-12(2)3/h4-6,8-9,12,14,16-17H,1,7,10-11H2,2-3H3

Weigh it out

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

Names and synonyms

14 names · show all
  • 2-Propanol, 1-[(1-methylethyl)amino]-3-[2-(2-propen-1-yl)phenoxy]-
  • 2-Propanol, 1-(o-allylphenoxy)-3-(isopropylamino)-
  • 2-Propanol, 1-[(1-methylethyl)amino]-3-[2-(2-propenyl)phenoxy]-
  • 1-[(1-Methylethyl)amino]-3-[2-(2-propen-1-yl)phenoxy]-2-propanol
  • 1-(o-Allylphenoxy)-3-(isopropylamino)-2-propanol
  • Alpheprol
  • 1-Isopropylamino-3-(2-allyl)phenoxypropan-2-ol
  • (±)-Alprenolol
  • Dl-Alprenolol
  • (RS)-Alprenolol
  • 1-(2-Allyl-phenoxy)-3-isopropylamino-propan-2-ol
  • 1-(Propan-2-ylamino)-3-(2-prop-2-enylphenoxy)propan-2-ol
  • [2-Hydroxy-3-[2-(prop-2-en-1-yl)phenoxy]propyl](propan-2-yl)amine
  • BRD-A O0993607

Work with Alprenolol

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

Alprenolol hydrochloride13707-88-593 % similar Oxprenolol hydrochloride6452-73-969 % similar Propranolol525-66-659 % similar (+)-Propranolol hydrochloride13071-11-956 % similar Propranolol hydrochloride318-98-956 % similar Propranolol hydrochloride3506-09-056 % similar (S)-Propranolol hydrochloride4199-10-456 % similar Carazolol57775-29-856 % similar

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

Same formula

2-Ethylhexyl P-aminobenzoate26218-04-2 1-[2-Amino-1-(4-methoxyphenyl)ethyl]cyclohexanol93413-77-5

Elsewhere

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