Basic information
- Standard SMILES
N#CCC1CCc2ccccc2N1- InChIKey
QZTBXCDPHAWCOL-UHFFFAOYSA-N- Molecular formula
- C11H12N2
- Average molar mass
- 172.23 g/mol
Names & identifiers
- Preferred name
- 2-Cyanomethyl-1,2,3,4-tetrahydroquinoline
- IUPAC
- 2-(1,2,3,4-tetrahydroquinolin-2-yl)acetonitrile
Names & synonyms
2-Cyanomethyl-1,2,3,4-tetrahydroquinoline2-CyanomethyltetrahydroquinolineSCHEMBL86523641,2,3,4-Tetrahydro-2-quinolinylacetonitrile #
Database identifiers
- PubChem CID
- 583419
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 35.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 215
Related reactions
2 records
Compound notes
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