Basic information
- Standard SMILES
ClCCCN1CC=C(c2ccccc2)CC1- InChIKey
UVWJFYASSBGLMW-UHFFFAOYSA-N- Molecular formula
- C14H18ClN
- Average molar mass
- 235.75 g/mol
Names & identifiers
- Preferred name
- 1-(3-Chloropropyl)-4-phenyl-1,2,3,6-tetrahydropyridine
- IUPAC
- 1-(3-chloropropyl)-4-phenyl-3,6-dihydro-2H-pyridine
Names & synonyms
SCHEMBL6162058UVWJFYASSBGLMW-UHFFFAOYSA-N1-(3-chloropropyl)-4-phenyl 1,2,3,6-tetrahydropyridine1-(3-chloropropyl)-4-phenyl-1,2,3,6-tetrahydropyridine
Database identifiers
- PubChem CID
- 9837583
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 231
Related reactions
12 records
Compound notes
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