Basic information
- CAS
1211495-62-3- Standard SMILES
Cc1ccnc(NC(=O)C(C)(C)CCl)c1- InChIKey
VXTJNGBYLRPGQT-UHFFFAOYSA-N- Molecular formula
- C11H15ClN2O
- Average molar mass
- 226.7 g/mol
- Monoisotopic mass
- 226.0872908
Names & identifiers
- Preferred name
- 3-Chloro-2,2-dimethyl-N-(4-methyl-2-pyridinyl)propanamide
- IUPAC
- 3-chloro-2,2-dimethyl-N-(4-methyl-2-pyridinyl)propanamide
Names & synonyms
DTXSID001198854AKOS0129917993-Chloro-2,2-dimethyl-N-(4-methyl-2-pyridinyl)propanamide3-chloro-2,2-dimethyl-N-(4-methylpyridin-2-yl)propanamide1211495-62-3
Database identifiers
- CAS
1211495-62-3- PubChem CID
- 63680903
- DTXSID
DTXSID001198854
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 231
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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