Fenethylline Hydrochloride
Basic information
- CAS
1892-80-4- Standard SMILES
CC(Cc1ccccc1)NCCn1cnc2c1c(=O)n(C)c(=O)n2C.Cl- InChIKey
MVXGSLGVWBVZCA-UHFFFAOYSA-N- Molecular formula
- C18H24ClN5O2
- Average molar mass
- 377.9 g/mol
- Monoisotopic mass
- 377.1618527
Names & identifiers
- Preferred name
- Fenethylline Hydrochloride
- IUPAC
- 1,3-dimethyl-7-[2-(1-phenylpropan-2-ylamino)ethyl]purine-2,6-dione;hydrochloride
Names & synonyms
Fenethylline hydrochlorideBiocaptonCaptagon hydrochlorideAmfetyline hydrochlorideFenetylline hydrochlorideFenethylline HCl1892-80-4DTXSID3048869YA7K8ADZ2VNSC-1698727-(2-(1-Methyl-2-phenylethylamino)ethyl)theophylline hydrochloride7-[2-(1-Methyl-2-phenylethylamino)ethyl]theophylline hydrochloride
Show more names
DTXCID0028795H-814Theophylline, 7-(2-((alpha-methylphenethyl)amino)ethyl)-, monohydrochlorideRefChem:921528217-580-8Fenethylline hydrochloride [USAN]V3Z39LK3EVFenetylline hydrochloride, (+)-
Database identifiers
- CAS
1892-80-4、22256-64-0、22256-65-1- PubChem CID
- 102710
- DTXSID
DTXSID3048869- ChEMBL
CHEMBL2107591- UNII
- HK6XYT4SE5、V3Z39LK3EV、YA7K8ADZ2V
- EC Number
- 217-580-8
Properties
Computed structural properties
- Topological polar surface area
- 70.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 494
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P270, P271, P301+P316, P304+P340, P319, P321, P330, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
A loosely defined group of drugs that tend to increase behavioral alertness, agitation, or excitation. They work by a variety of mechanisms, but usually not by direct excitation of neurons. The many drugs that have such actions as side effects to their main therapeutic use are not included here.
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Compound notes
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