Basic information
- CAS
117821-10-0- Standard SMILES
C[C@H]1[C@@H](O)[C@@H](O)[C@H](O)CN1C- InChIKey
ARIAWFPKUVJPLU-WNJXEPBRSA-N- Molecular formula
- C7H15NO3
- Average molar mass
- 161.2 g/mol
- Monoisotopic mass
- 161.10519334
Names & identifiers
- Preferred name
- N-Methyl-1,5-dideoxy-1,5-imino-L-fucitol
- IUPAC
- (2S,3R,4S,5R)-1,2-dimethylpiperidine-3,4,5-triol
Names & synonyms
MeFTN-Methyl-1,5-dideoxy-1,5-imino-L-fucitol117821-10-03,4,5-Piperidinetriol, 1,2-dimethyl-, (2S-(2alpha,3alpha,4alpha,5beta))-(2S,3R,4S,5R)-1,2-dimethylpiperidine-3,4,5-triolSCHEMBL9495730DTXSID901519193,4,5-Piperidinetriol, 1,2-dimethyl-, [2S-(2a,3a,4a,5b)]-
Database identifiers
- CAS
117821-10-0- PubChem CID
- 452005
- DTXSID
DTXSID90151919
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 63.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 142
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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