N~3~-(2,6-Dimethylphenyl)-N,N-dimethyl-beta-alaninamide
Basic information
- CAS
319-54-0- Standard SMILES
Cc1cccc(C)c1NCCC(=O)N(C)C- InChIKey
XVUHVAJAQLBNFR-UHFFFAOYSA-N- Molecular formula
- C13H20N2O
- Average molar mass
- 220.31 g/mol
- Monoisotopic mass
- 220.15756327
Names & identifiers
- Preferred name
- N~3~-(2,6-Dimethylphenyl)-N,N-dimethyl-beta-alaninamide
- IUPAC
- 3-(2,6-dimethylanilino)-N,N-dimethylpropanamide
Names & synonyms
DTXSID001200350AKOS011615356N~3~-(2,6-Dimethylphenyl)-N,N-dimethyl-beta-alaninamidePropanamide, 3-[(2,6-dimethylphenyl)amino]-N,N-dimethyl-319-54-0
Database identifiers
- CAS
319-54-0- PubChem CID
- 62330968
- DTXSID
DTXSID001200350
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 218
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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