Basic information
- CAS
3376-94-1- Standard SMILES
CCC(=O)OC(Cc1ccccc1)(c1ccccc1)C(C)CNC- InChIKey
IKACRWYHQXOSGM-UHFFFAOYSA-N- Molecular formula
- C21H27NO2
- Average molar mass
- 325.4 g/mol
- Monoisotopic mass
- 325.2041791
Overview
Norpropoxyphene is a stilbenoid.
Names & identifiers
- Preferred name
- 3-Methyl-4-(methylamino)-1,2-diphenyl-2-butanyl propionate
- IUPAC
- [3-methyl-4-(methylamino)-1,2-diphenylbutan-2-yl] propanoate
- English name
- norpropoxyphene
- Molecular formula
- C21H27NO2
- Molecular weight
- 325.44
Names & synonyms
3376-94-1DTXSID102739603-Methyl-4-(methylamino)-1,2-diphenyl-2-butanyl propionateRefChem:1068244DTXCID40196451[3-methyl-4-(methylamino)-1,2-diphenylbutan-2-yl] propanoate1,2-Diphenyl-4-(methylamino)-3-methyl-2-butanol propionateNorpropoxyphene #1Norpropoxyphene #2Propoxyphene, N-desmethyl1,2-Diphenyl-3-methyl-4-(methylamino)-2-butanol propionate (ester)1,2-Diphenyl-4-(methylamino)-3-methyl-2-butanol propionate (ester)
Show more names
norpropoxypheneNorpropoxyphene-d5NordextropropoxyphenePropionic acid 1-benzyl-1-phenyl-2-methyl-3-(methylamino)propyl esterPropanoic acid 1-phenyl-1-benzyl-2-methyl-3-(methylamino)propyl esterBenzeneethanol, α-[1-methyl-2-(methylamino)ethyl]-α-phenyl-, 1-propanoate
2-BUTANOL, 1,2-DIPHENYL-4-(METHYLAMINO)-3-METHYL-, PROPIONATE (ester)SCHEMBL32680999CHEBI:166662IKACRWYHQXOSGM-UHFFFAOYSA-N2-BUTANOL, 1,2-DIPHENYL-3-METHYL-4-(METHYLAMINO)-, PROPIONATE (ESTER)66796-40-5NS001009641-Benzyl-2-methyl-3-(methylamino)-1-phenylpropyl propionate #
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 372
Physicochemical properties
- Boiling point
- 446.7 · 446.7±45.0 °C(Predicted)
- Density
- 1.042 · 1.042±0.06 g/cm3(Predicted)
- pka
- 10.08 · 10.08±0.20(Predicted)
- FDA UNII
- 812 VVS96K · C812VVS96K
- EPA Substance Registry System
- 1 · Benzeneethanol, ?-[1-methyl-2-(methylamino)ethyl]-?-phenyl-, 1-propanoate (3376-94-1)
Chemistry & industry
Pharmacology
Metabolism/MetabolitesNordextropropoxyphene is a known human metabolite of dextropropoxyphene.
Cellular LocationsMembrane
Suppliers1 total
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Additional notes
DefinitionChEBI: Norpropoxyphene is a stilbenoid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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