4-Methyl-5-(2,3,4,5,6-pentadeuteriophenyl)-4,5-dihydro-1,3-oxazol-2-amine
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Basic information
- CAS
152477-94-6- Standard SMILES
[2H]c1c([2H])c([2H])c(C2OC(N)=NC2C)c([2H])c1[2H]- InChIKey
LJQBMYDFWFGESC-VIQYUKPQSA-N- Molecular formula
- C10H12N2O
- Average molar mass
- 181.25 g/mol
- Monoisotopic mass
- 181.12634674
Names & identifiers
- Preferred name
- 4-Methyl-5-(2,3,4,5,6-pentadeuteriophenyl)-4,5-dihydro-1,3-oxazol-2-amine
- IUPAC
- 4-methyl-5-(2,3,4,5,6-pentadeuteriophenyl)-4,5-dihydro-1,3-oxazol-2-amine
- English name
- McN 822-d5
- Molecular formula
- C10H12N2O
- Molecular weight
- 176.21508
Names & synonyms
152477-94-64-Methyl-5-(2,3,4,5,6-pentadeuteriophenyl)-4,5-dihydro-1,3-oxazol-2-amine4-Methylaminorex-d5DTXSID308580114-Methyl-5-(2H5)phenyl-4,5-dihydro-1,3-oxazol-2-amine4-Methyl-5-(~2~H_5_)phenyl-4,5-dihydro-1,3-oxazol-2-amineMcN 822-d54-Methyl AMinorex-d52-AMino-4-Methyl-5-(phenyl-d5)-2-oxazoline4,5-Dihydro-4-Methyl-5-(phenyl-d5)-2-oxazolaMine
Database identifiers
- CAS
152477-94-6- PubChem CID
- 71750187
- DTXSID
DTXSID30858011
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 209
Physicochemical properties
- InChI
- InChI=1S/C10H12N2O/c1-7-9(13-10(11)12-7)8-5-3-2-4-6-8/h2-7,9H,1H3,(H2,11,12)
- InChIKey
- LJQBMYDFWFGESC-UHFFFAOYSA-N
- SMILES
- c1cc(C2C(C)N=C(N)O2)ccc1
Chemistry & industry
Applications
UsesLabelled 4-Methylaminorex, a stimulant drug of the 2-amino-5-aryloxazoline class. 4-Methylaminorex has effects similar to Methamphetamine (M258795) but with much longer duration. Studies show that effects of 4-Methylaminorex are stimulant in nature, producing euphoria, an increase in attention, and increased cognition. Controlled Substance.
Related reactions
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Compound notes
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