Allosedamine
Basic information
- CAS
497-89-2- Standard SMILES
CN1CCCCC1CC(O)c1ccccc1- InChIKey
GOWRYACIDZSIHI-UHFFFAOYSA-N- Molecular formula
- C14H21NO
- Average molar mass
- 219.32 g/mol
- Monoisotopic mass
- 219.16231429
Overview
2-(1-methylpiperidin-2-yl)-1-phenylethanol has been reported in Lobelia inflata with data available.
Names & identifiers
- Preferred name
- Allosedamine
- IUPAC
- 2-(1-methylpiperidin-2-yl)-1-phenylethanol
Names & synonyms
Allosedamine497-89-22-(1-methyl-2-piperidyl)-1-phenyl-ethanold,l-Sedaminorb1989864SCHEMBL30136172GOWRYACIDZSIHI-UHFFFAOYSA-NNSC340064AKOS040740361NSC-340064DS-003232AE-641/05563024
Show more names
T131569
Database identifiers
- CAS
497-89-2- PubChem CID
- 433956
- Nikkaji
- J505.942I
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 201
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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