Ohmefentanyl
Basic information
- CAS
78995-14-9- Standard SMILES
CCC(=O)N(c1ccccc1)C1CCN(CC(O)c2ccccc2)CC1C- InChIKey
FRPRNNRJTCONEC-UHFFFAOYSA-N- Molecular formula
- C23H30N2O2
- Average molar mass
- 366.5 g/mol
- Monoisotopic mass
- 366.2307282
Overview
Ohmefentanyl is a monocarboxylic acid amide resulting from the formal condensation of the aryl amino group of 2-(4-anilino-3-methylpiperidin-1-yl)-1-phenylethanol with propanoic acid. It is a synthetic analogue of fentanyl. It has a role as an opioid analgesic and a mu-opioid receptor agonist. It is an anilide, a member of benzyl alcohols, a member of piperidines, a monocarboxylic acid amide and a tertiary amino compound.
Names & identifiers
- Preferred name
- Ohmefentanyl
- IUPAC
- N-[1-(2-hydroxy-2-phenylethyl)-3-methylpiperidin-4-yl]-N-phenylpropanamide
- English name
- Ohmefentanyl
- Molecular formula
- C23H30N2O2
- Molecular weight
- 366.5
Names & synonyms
OhmefentanylBETA-HYDROXY-3-METHYLFENTANYL78995-14-9F 7302N-[1-(2-hydroxy-2-phenylethyl)-3-methylpiperidin-4-yl]-N-phenylpropanamideF-7302Y8263089ZXIDS-NB-010DTXSID50868495IDS-NB-010(SECT.3)RTI-4614-4N-(1-(2-hydroxy-2-phenylethyl)-3-methylpiperidin-4-yl)-N-phenylpropanamide
Show more names
F 730Ohmenfentanyl-Hydroxy-3-methylfentanylβ-Hydroxy-3-methylfentanilb-Hydroxy-3-methylfentanylBeta-Hydroxy-3-methylfentanyl (100ug/ml in Methanol)Beta-Hydroxy-3-methylfentanyl (100μg/ml in Methanol)
RefChem:167999DTXCID90816596RTI-46144RTI 6414-4RTI-6414-4N-(1-(2-hydroxy-2-phenylethyl)-3-methyl-4-piperidyl)-N-phenylpropanamideN-(1-(beta-hydroxy beta-phenethyl)-3-methyl-4-piperidyl)-N-phenylpropionamideCHEMBL333410
Database identifiers
- CAS
78995-14-9
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 457
Experimental & physicochemical properties
Drugs
DEA NFLIS-Drug Category -> Fentanyl and Fentanyl-related
DEA Schedule I Controlled Substance -> Opiates
Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds
Physicochemical properties
- Boiling point
- 516.6 · 516.6±50.0 °C(Predicted)
- Density
- 1.118 · 1.118±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 14.19 · 14.19±0.20(Predicted)
- color
- Off-White to Pale Beige
- FDA UNII
- 8263089 ZX · Y8263089ZX
- DEA Controlled Substances
- 9831 CSA · CSCN: 9831CSA 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: 9831CSA SCH: Schedule INARC: Yes
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationCompounds capable of relieving pain without the loss of CONSCIOUSNESS.
Applications
UsesA prodrug opioid. A Fentanyl analog. Controlled Substance
Additional notes
DefinitionChEBI: Ohmefentanyl is a member of piperidines.
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…