Amitriptyline hydrochlorideProduct ingredient for Amitriptyline
- Name
- Amitriptyline hydrochloride
- Drug Entry
- Amitriptyline
Amitriptyline is a tricyclic antidepressant that has been used to treat depression for decades. ELAVIL, a previously approved branded product of amitriptyline, was first approved by the FDA in 1961.11 Amitriptyline has been investigated in the treatment of pain-related conditions, attributed to its analgesic properties.6
- Accession Number
- DBSALT000009
- Structure
- Synonyms
- Amitriptyline HCl
- UNII
- 26LUD4JO9K
- CAS Number
- 549-18-8
- Weight
- Average: 313.864
Monoisotopic: 313.15972748 - Chemical Formula
- C20H24ClN
- InChI Key
- KFYRPLNVJVHZGT-UHFFFAOYSA-N
- InChI
- InChI=1S/C20H23N.ClH/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20;/h3-6,8-12H,7,13-15H2,1-2H3;1H
- IUPAC Name
- dimethyl(3-{tricyclo[9.4.0.0^{3,8}]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}propyl)amine hydrochloride
- SMILES
- Cl.CN(C)CCC=C1C2=CC=CC=C2CCC2=CC=CC=C12
- External Links
- PubChem Compound
- 11065
- ChemSpider
- 10594
- ChEBI
- 2667
- ChEMBL
- CHEMBL1200964
- Wikipedia
- Amitriptyline
- Predicted Properties
Property Value Source Water Solubility 0.0045 mg/mL ALOGPS logP 5.1 ALOGPS logP 4.81 Chemaxon logS -4.8 ALOGPS pKa (Strongest Basic) 9.76 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 1 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 3.24 Å2 Chemaxon Rotatable Bond Count 3 Chemaxon Refractivity 101.51 m3·mol-1 Chemaxon Polarizability 33.5 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon