DL-Methylephedrine hydrochlorideProduct ingredient for DL-Methylephedrine
- Name
- DL-Methylephedrine hydrochloride
- Drug Entry
- DL-Methylephedrine
Methylephedrine is a sympathomimetic amine that appears in various over-the-counter cough and cold medications throughout the world 9, 10, 11. The abuse of methylephedrine-containing medications has been reported in Japan. Methylephedrine is not legally available in the United States, but has been identified in cases of drug abuse 7.
- Accession Number
- DBSALT001572
- Structure
- Synonyms
- 2-dimethylamino-1-phenylpropanol hydrochloride / Methylephedrine hydrochloride / Methylephedrine hydrochloride-DL / Methylephedrine hydrochloride, (+/-)- / Methylephedrine hydrochloride, DL- / N-methylephedrine DL-form hydrochloride / N-methylephedrine hydrochloride, DL- / N,N-dimethylnorephedrine hydrochloride
- UNII
- 99214P83XM
- CAS Number
- 18760-80-0
- Weight
- Average: 215.72
Monoisotopic: 215.1076919 - Chemical Formula
- C11H18ClNO
- InChI Key
- NTCYWJCEOILKNG-ROLPUNSJSA-N
- InChI
- InChI=1S/C11H17NO.ClH/c1-9(12(2)3)11(13)10-7-5-4-6-8-10;/h4-9,11,13H,1-3H3;1H/t9-,11-;/m0./s1
- IUPAC Name
- (1R,2S)-2-(dimethylamino)-1-phenylpropan-1-ol hydrochloride
- SMILES
- Cl.C[C@@H]([C@H](O)C1=CC=CC=C1)N(C)C
- External Links
- Predicted Properties
Property Value Source Water Solubility 15.4 mg/mL ALOGPS logP 1.73 ALOGPS logP 1.7 Chemaxon logS -1.1 ALOGPS pKa (Strongest Acidic) 13.88 Chemaxon pKa (Strongest Basic) 8.86 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 2 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 23.47 Å2 Chemaxon Rotatable Bond Count 3 Chemaxon Refractivity 54.98 m3·mol-1 Chemaxon Polarizability 20.55 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon