Basic information
- CAS
97564-80-2- Standard SMILES
C[C@H]1C[C@H](O)[C@H](C)N(C)C1- InChIKey
FYSXYJLZTKYTDU-FXQIFTODSA-N- Molecular formula
- C8H17NO
- Average molar mass
- 143.23 g/mol
- Monoisotopic mass
- 143.13101417
Names & identifiers
- Preferred name
- (2S,3S,5S)-1,2,5-trimethylpiperidin-3-ol
- IUPAC
- (2S,3S,5S)-1,2,5-trimethylpiperidin-3-ol
Names & synonyms
(2S,3S,5S)-1,2,5-trimethylpiperidin-3-olDTXSID90125906197564-80-23-Piperidinol, 1,2,5-trimethyl-, (2I+/-,3I+/-,5I(2))-
Database identifiers
- CAS
97564-80-2- PubChem CID
- 7201191
- DTXSID
DTXSID901259061
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 116
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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