Basic information
- CAS
84308-99-6- Standard SMILES
Cc1cccc(C)c1N(CC(C)CN(C)C)C(=O)Cc1ccccc1- InChIKey
NFNJSRBJRGFHHC-UHFFFAOYSA-N- Molecular formula
- C22H30N2O
- Average molar mass
- 338.5 g/mol
- Monoisotopic mass
- 338.23581359
Names & identifiers
- Preferred name
- Acetanilide, N-(3-(dimethylamino)-2-methylpropyl)-2',6'-dimethyl-2-phenyl-
- IUPAC
- N-[3-(dimethylamino)-2-methylpropyl]-N-(2,6-dimethylphenyl)-2-phenylacetamide
- English name
- N-(3-Dimethylamino-2-methylpropyl)-2',6'-dimethyl-2-phenylacetanilide
- Molecular formula
- C22H30N2O
- Molecular weight
- 338.49
Names & synonyms
SA 4984308-99-6N-(3-(Dimethylamino)-2-methylpropyl)-2',6'-dimethyl-2-phenylacetanilideACETANILIDE, N-(3-(DIMETHYLAMINO)-2-METHYLPROPYL)-2',6'-DIMETHYL-2-PHENYL-RefChem:315827N-[3-(dimethylamino)-2-methylpropyl]-N-(2,6-dimethylphenyl)-2-phenylacetamideSCHEMBL29393484DTXSID801004615SA-49N-(3-Dimethylamino-2-methylpropyl)-2',6'-dimethyl-2-phenylacetanilideBenzeneacetamide, N-[3-(dimethylamino)-2-methylpropyl]-N-(2,6-dimethylphenyl)-
Database identifiers
- CAS
84308-99-6- PubChem CID
- 55231
- DTXSID
DTXSID801004615- Nikkaji
- J79.148B
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 393
Physicochemical properties
- Boiling point
- 474 · 474.0±45.0 °C(Predicted)
- Density
- 1.043 · 1.043±0.06 g/cm3(Predicted)
- pka
- 9.28 · 9.28±0.28(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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