1-Methyl-4-tert-butyl-delta3-piperideine
Basic information
- CAS
57070-49-2- Standard SMILES
CN1CC=C(C(C)(C)C)CC1- InChIKey
OIYHBEVTDGYUAU-UHFFFAOYSA-N- Molecular formula
- C10H19N
- Average molar mass
- 153.26 g/mol
- Monoisotopic mass
- 153.15174961
Names & identifiers
- Preferred name
- 1-Methyl-4-tert-butyl-delta3-piperideine
- IUPAC
- 4-tert-butyl-1-methyl-3,6-dihydro-2H-pyridine
Names & synonyms
1-Methyl-4-tert-butyl-delta3-piperideine57070-49-2DTXSID70205681Pyridine, 4-(1,1-dimethylethyl)-1,2,3,6-tetrahydro-1-methyl-RefChem:231896DTXCID001281724-tert-butyl-1-methyl-1,2,3,6-tetrahydropyridineCHEMBL318236SCHEMBL7940285
Database identifiers
- CAS
57070-49-2- PubChem CID
- 180571
- DTXSID
DTXSID70205681- ChEMBL
CHEMBL318236- Nikkaji
- J438.800C
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 162
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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