Basic information
- Standard SMILES
CN(C)C=C1CN(C(=O)OC(C)(C)C)CCC1=O- InChIKey
YUSMZDVTEOAHDL-UHFFFAOYSA-N- Molecular formula
- C13H22N2O3
- Average molar mass
- 254.33 g/mol
- Monoisotopic mass
- 254.16304257
Names & identifiers
- Preferred name
- tert-butyl 3-[(dimethylamino)methylene]-4-oxotetrahydro-1(2H)-pyridinecarboxylate
- IUPAC
- tert-butyl 3-(dimethylaminomethylidene)-4-oxopiperidine-1-carboxylate
Names & synonyms
157327-41-81-BOC-3-[(DIMETHYLAMINO)METHYLENE]-4-OXOPIPERIDINEMFCD08443986tert-butyl 3-[(dimethylamino)methylene]-4-oxotetrahydro-1(2H)-pyridinecarboxylate3-Dimethylaminomethylene-4-oxo-piperidine-1-carboxylic acid tert-butyl estertert-butyl 3-(dimethylaminomethylidene)-4-oxopiperidine-1-carboxylate1310796-19-01-Boc-3-((Dimethylamino)methylene)-4-oxopiperidinetert-butyl-3-((dimethylamino)methylene)-4-oxopiperidine-1-carboxylatetert-butyl-3-[(dimethylamino)methylene]-4-oxopiperidine-1-carboxylateSCHEMBL785942tert-Butyl 3-((dimethylamino)methylene)-4-oxopiperidine-1-carboxylate
Show more names
tert-Butyl 3-[(dimethylamino)methylene]-4-oxopiperidine-1-carboxylate1-Piperidinecarboxylic acid, 3-[(dimethylamino)methylene]-4-oxo-, 1,1-dimethylethyl esterTERT-BUTYL (3Z)-3-[(DIMETHYLAMINO)METHYLIDENE]-4-OXOPIPERIDINE-1-CARBOXYLATEYUSMZDVTEOAHDL-UHFFFAOYSA-NAKOS025244025SB33938SY008669DB-064167
Database identifiers
- PubChem CID
- 53395404
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 367
Related reactions
64 records
Compound notes
Loading…