alpha-Methylthiofentanyl
Basic information
- CAS
103963-66-2- Standard SMILES
CCC(=O)N(c1ccccc1)C1CCN(C(C)Cc2cccs2)CC1- InChIKey
YPOXDUYRRSUFFG-UHFFFAOYSA-N- Molecular formula
- C21H28N2OS
- Average molar mass
- 356.5 g/mol
- Monoisotopic mass
- 356.19223469
Overview
alpha-Methylthiofentanyl 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
- alpha-Methylthiofentanyl
- IUPAC
- N-phenyl-N-[1-(1-thiophen-2-ylpropan-2-yl)piperidin-4-yl]propanamide
- English name
- a-Methylthio Fentanyl
- Molecular formula
- C21H28N2OS
- Molecular weight
- 356.52
Names & synonyms
alpha-Methylthiofentanyl103963-66-2NF684LIF79ACSCN-9832IDS-NA-017.ALPHA.-METHYLTHIOFENTANYLDTXSID90861243IDS-NA-017(SECT.3).ALPHA.-METHYL-THIOFENTANYLN-(1-Methyl-2-(2-thienyl)ethyl-4-piperidinyl)-N-phenylpropanamideN-Phenyl-N-{1-[1-(thiophen-2-yl)propan-2-yl]piperidin-4-yl}propanamidePropanamide, N-(1-(1-methyl-2-(2-thienyl)ethyl)-4-piperidinyl)-N-phenyl-
Show more names
α-Methylthio Fentanyla-Methylthio FentanylN-phenyl-N-[1-(1-thiophen-2-ylpropan-2-yl)piperidin-4-yl]propanamideN-[1-[1-Methyl-2-(2-thienyl)ethyl]-4-piperidinyl]-N-phenylpropanamide
N-(1-(1-METHYL-2-(2-THIENYL)ETHYL)-4-PIPERIDYL)PROPIONANILIDEPropanamide, N-[1-[1-methyl-2-(2-thienyl)ethyl]-4-piperidinyl]-N-phenyl-N-[1-methyl-2-(2-thienyl)ethyl-4-piperidinyl]-N-phenylpropanamideN-{1-[1-Methyl-2-(2-thienyl)ethyl]-4-piperidyl}propionanilideN-phenyl-N-(1-(1-(thiophen-2-yl)propan-2-yl)piperidin-4-yl)propanamidealpha-Methylthiofentanyl (N-(1-methyl-2-(2-thienyl)ethyl-4-piperidinyl)-N-phenylpropanamide)alpha-Methylthiofentanyl (N-[1-methyl-2-(2-thienyl)ethyl-4-piperidinyl]-N-phenylpropanamide)RefChem:555884
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 416
Experimental & physicochemical properties
Drugs
DEA NFLIS-Drug Category -> Fentanyl and Fentanyl-related
DEA Schedule I Controlled Substance -> Opiates
Physicochemical properties
- Boiling point
- 474.8 · 474.8±40.0 °C(Predicted)
- Density
- 1.137 · 1.137±0.06 g/cm3(Predicted)
- pka
- 8.74 · 8.74±0.20(Predicted)
- FDA UNII
- 684 LIF79 · NF684LIF79
- DEA Controlled Substances
- 9832 CSA · CSCN: 9832CSA 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: 9832CSA SCH: Schedule INARC: Yes
Chemistry & industry
Applications
UsesA Fentanyl analog. An opiate receptor. Controlled Substance
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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