Basic information
- Standard SMILES
C1=C(c2cccc3c2OCCO3)CCNC1- InChIKey
QFTGXYBPWKLXDZ-UHFFFAOYSA-N- Molecular formula
- C13H15NO2
- Average molar mass
- 217.26 g/mol
Names & identifiers
- Preferred name
- 4-(2,3-Dihydro-1,4-benzodioxin-5-yl)-1,2,3,6-tetrahydropyridine
- IUPAC
- 4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1,2,3,6-tetrahydropyridine
Names & synonyms
SCHEMBL6588482
Database identifiers
- PubChem CID
- 19096239
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 277
Related reactions
1 records
Compound notes
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