Basic information
- Standard SMILES
C=CCO[C@@H]1C[C@H](N)c2cc(OC(C)C)ccc21- InChIKey
WFICMJFUIQMALX-LSDHHAIUSA-N- Molecular formula
- C15H21NO2
- Average molar mass
- 247.33 g/mol
Names & identifiers
- Preferred name
- (1S,3R)-3-(allyloxy)-6-isopropoxy-2,3-dihydro-1H-inden-1-amine
- IUPAC
- (1S,3R)-6-propan-2-yloxy-3-prop-2-enoxy-2,3-dihydro-1H-inden-1-amine
Names & synonyms
SCHEMBL2980027WFICMJFUIQMALX-LSDHHAIUSA-N(1S,3R)-3-(allyloxy)-6-isopropoxy-2,3-dihydro-1H-inden-1-amine
Database identifiers
- PubChem CID
- 59423754
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 280
Related reactions
1 records
Compound notes
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