Racepinephrine hydrochlorideProduct ingredient for Racepinephrine

Name
Racepinephrine hydrochloride
Drug Entry
Racepinephrine

Racepinephrine is a racemic mixture consisting of d-Epinephrine and l-Epinephrine enantiomers. Epinephrine is a non-selective α- and β-adrenergic receptor agonist. It is a bronchodilator used in the temporary relief of mild symptoms of intermittent asthma including wheezing, tightness of chest and shortness of breath. It is an active ingredient in oral inhalation over-the-counter products as racepinephrine hydrochloride.

Accession Number
DBSALT001518
Structure
Synonyms
Racemic epinephrine hydrochloride / Racepinephrine HCl
UNII
336096P2WE
CAS Number
329-63-5
Weight
Average: 219.67
Monoisotopic: 219.066221
Chemical Formula
C9H14ClNO3
InChI Key
ATADHKWKHYVBTJ-UHFFFAOYSA-N
InChI
InChI=1S/C9H13NO3.ClH/c1-10-5-9(13)6-2-3-7(11)8(12)4-6;/h2-4,9-13H,5H2,1H3;1H
IUPAC Name
4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol hydrochloride
SMILES
Cl.CNCC(O)C1=CC=C(O)C(O)=C1
ChemSpider
5711
ChEMBL
CHEMBL1255663
Predicted Properties
PropertyValueSource
Water Solubility18.6 mg/mLALOGPS
logP-0.82ALOGPS
logP-0.43Chemaxon
logS-0.99ALOGPS
pKa (Strongest Acidic)9.69Chemaxon
pKa (Strongest Basic)8.91Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count4Chemaxon
Hydrogen Donor Count4Chemaxon
Polar Surface Area72.72 Å2Chemaxon
Rotatable Bond Count3Chemaxon
Refractivity49.23 m3·mol-1Chemaxon
Polarizability18.83 Å3Chemaxon
Number of Rings1Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon