Basic information
- CAS
468-59-7- Standard SMILES
CCC(=O)O[C@]1(c2ccccc2)CCN(C)C[C@H]1C- InChIKey
UVAZQQHAVMNMHE-CZUORRHYSA-N- Molecular formula
- C16H23NO2
- Average molar mass
- 261.36 g/mol
- Monoisotopic mass
- 261.17287898
Overview
Betaprodine is a DEA Schedule I controlled substance. Substances in the DEA Schedule I have no currently accepted medical use in the United States, a lack of accepted safety for use under medical supervision, and a high potential for abuse. It is a Opiates substance.
Names & identifiers
- Preferred name
- Betaprodine
- IUPAC
- [(3R,4R)-1,3-dimethyl-4-phenylpiperidin-4-yl] propanoate
- English name
- betaprodine
- Molecular formula
- C16H23NO2
- Molecular weight
- 261.36
Names & synonyms
Betaprodinebeta-ProdineBetaprodinaBetaprodinum.beta.-Prodinol468-59-7DTXSID1046766NU-1779Betaprodinum [INN-Latin].beta.-ProdineBetaprodina [INN-Spanish]Dl-.beta.-prodine
Show more names
β-ProdinolUVAZQQHAVMNMHE-CZUORRHYSA-N(1,3-dimethyl-4-phenylpiperidin-4-yl) propanoate(1,3-dimethyl-4-phenyl-piperidin-4-yl) propanoatepropionic acid (1,3-dimethyl-4-phenyl-4-piperidyl) ester4-Piperidinol, 1,3-dimethyl-4-phenyl-, 4-propanoate, (3R,4R)-rel-rel-Propionic acid (3R*)-1,3β*-dimethyl-4-phenylpiperidine-4α*-yl ester
Betaprodine [INN:BAN:DCF]UNII-21J54X4Z4Z21J54X4Z4ZAcscn-9611EINECS 207-411-6BETAPRODINE [INN]IDS-NB-006DTXCID9026766
Database identifiers
- CAS
468-59-7- PubChem CID
- 5284516
- DTXSID
DTXSID1046766
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 312
Experimental & physicochemical properties
Drugs
DEA NFLIS-Drug Category -> Narcotic Analgesics
DEA Schedule I Controlled Substance -> Opiates
Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds
Pharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Boiling point
- 338.4 · 338.4±42.0 °C(Predicted)
- Density
- 1.06 · 1.06±0.1 g/cm3(Predicted)
- pka
- 8.7 · pKa 8.7 (Uncertain)
- FDA UNII
- 21 J54X4Z4Z · 21J54X4Z4Z
- DEA Controlled Substances
- 9611 CSA · CSCN: 9611CSA SCH: Schedule INARC: Yes
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationDEA schedule I controlled substance
Safety data
- DEA Controlled Substances
- CSCN: 9611CSA SCH: Schedule INARC: Yes
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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