Basic information
- CAS
39627-97-9- Standard SMILES
Cc1cccc(C)c1NC(=O)C(C)(C)C- InChIKey
UTKJYPVBWJTOAS-UHFFFAOYSA-N- Molecular formula
- C13H19NO
- Average molar mass
- 205.3 g/mol
- Monoisotopic mass
- 205.14666423
Names & identifiers
- Preferred name
- N-(2,6-Dimethylphenyl)-2,2-dimethylpropanamide
- IUPAC
- N-(2,6-dimethylphenyl)-2,2-dimethylpropanamide
Names & synonyms
N-(2,6-Dimethylphenyl)-2,2-dimethylpropanamide39627-97-9RefChem:360222SCHEMBL901118CCG-834UTKJYPVBWJTOAS-UHFFFAOYSA-NDTXSID701247268AKOS003442093N-(2,6-Dimethylphenyl)-2,2-dimethylpropanamide #Propanamide, 2,2-dimethyl-N-(2,6-dimethylphenyl)-
Database identifiers
- CAS
39627-97-9- PubChem CID
- 545409
- DTXSID
DTXSID701247268- Nikkaji
- J1.185.975E
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 219
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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