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Chlorphentermine hydrochloride , Serotonin transporter substrate, CAS No.151-06-4, Serotonin transporter substrate
Basic Description
Synonyms
Chlorphentermine hydrochloride | CHLORPHENTERMINE HYDROCHLORIDE (MART.) | RL11HOJ7DM | 4-Chloro-?,?-dimethylbenzeneethanamine hydrochloride | Lucofen | AKOS015894640 | [2-(4-chlorophenyl)-1,1-dimethylethyl]amine hydrochloride | Lucofene | Hydrochloride, C
Action Type
SUBSTRATE
Mechanism of action
Serotonin transporter substrate
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Amphetamines and derivatives
Alternative Parents
Phenylpropanes Chlorobenzenes Aralkylamines Aryl chlorides Organopnictogen compounds Organochlorides Monoalkylamines Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Amphetamine or derivatives - Phenylpropane - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Organonitrogen compound - Organochloride - Organohalogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Amine - Hydrochloride - Primary amine - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as amphetamines and derivatives. These are organic compounds containing or derived from 1-phenylpropan-2-amine.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
IUPAC Name
1-(4-chlorophenyl)-2-methylpropan-2-amine;hydrochloride
INCHI
InChI=1S/C10H14ClN.ClH/c1-10(2,12)7-8-3-5-9(11)6-4-8;/h3-6H,7,12H2,1-2H3;1H
InChIKey
WEJDYJKJPUPMLH-UHFFFAOYSA-N
Smiles
CC(C)(CC1=CC=C(C=C1)Cl)N.Cl
Isomeric SMILES
CC(C)(CC1=CC=C(C=C1)Cl)N.Cl
PubChem CID
65477
Molecular Weight
220.14
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
220.140 g/mol
XLogP3
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
2
Exact Mass
219.058 Da
Monoisotopic Mass
219.058 Da
Topological Polar Surface Area
26.000 Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
137.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
2
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