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Cotriptyline

HCID 71935
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Basic information

CAS
34662-67-4
Standard SMILES
CN(C)CC(=O)C=C1c2ccccc2CCc2ccccc21
InChIKey
DRNINDKQWDOFMO-UHFFFAOYSA-N
Molecular formula
C20H21NO
Average molar mass
291.4 g/mol
Monoisotopic mass
291.16231429

Overview

Cotriptyline is a small molecule drug. Cotriptyline has a monoisotopic molecular weight of 291.16 Da.

Names & identifiers

Preferred name
Cotriptyline
IUPAC
1-(dimethylamino)-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidene)propan-2-one
English name
Cotriptyline
Molecular formula
C20H21NO
Molecular weight
291.39

Names & synonyms

Cotriptyline34662-67-4CotriptilinaCotriptylinumKQJ4QI511CDTXSID50188221RefChem:128215DTXCID8011071210,11-dihydro-5H-dibenzo(a,d)cycloheptenylidene-5-3-dimethylamino-2-propanoneCotriptyline [INN:DCF]1-(dimethylamino)-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidene)propan-2-oneSD 2203-01
Show more names
1-(Dimethylamino)-3-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-2-propanone2-Propanone, 1-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-3-(dimethylamino)-
1-(Dimethylamino)-3-(10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-ylidene)-2-propanoneUNII-KQJ4QI511CCotriptylinum [INN-Latin]Cotriptilina [INN-Spanish]COTRIPTYLINE [INN]SCHEMBL2107759CHEMBL2106088SCHEMBL30801390

Database identifiers

CAS
34662-67-4
PubChem CID
71935
DTXSID
DTXSID50188221
ChEMBL
CHEMBL2106088
UNII
KQJ4QI511C
Nikkaji
J19.427A

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
22
Formal charge
0
Complexity
399

Physicochemical properties

Boiling point
430.5 · 430.5±33.0 °C(Predicted)
Density
1.143 · 1.143±0.06 g/cm3(Predicted)
pka
6.8 · 6.80±0.28(Predicted)
FDA UNII
4 QI511C · KQJ4QI511C

Chemistry & industry

Pharmacology

MeSH Pharmacological Classification · 1 item

Mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions. Several MONOAMINE OXIDASE INHIBITORS are useful as antidepressants apparently as a long-term consequence of their modulation of catecholamine levels. The tricyclic compounds useful as antidepressive agents (ANTIDEPRESSIVE AGENTS, TRICYCLIC) also appear to act through brain catecholamine systems. A third group (ANTIDEPRESSIVE AGENTS, SECOND-GENERATION) is a diverse group of drugs including some that act specifically on serotonergic systems.

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Compound notes

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