Basic information
- Standard SMILES
N#CCCCCN1CCN(c2ccc(Cl)c(Cl)c2)CC1- InChIKey
KHBBGXOQJPBHHI-UHFFFAOYSA-N- Molecular formula
- C15H19Cl2N3
- Average molar mass
- 312.2 g/mol
- Monoisotopic mass
- 311.095603
Names & identifiers
- Preferred name
- 4-(3,4-Dichlorophenyl)-1-piperazinepentanenitrile
- IUPAC
- 5-[4-(3,4-dichlorophenyl)piperazin-1-yl]pentanenitrile
Names & synonyms
SCHEMBL5185979KHBBGXOQJPBHHI-UHFFFAOYSA-N4-(3,4-dichlorophenyl)-1-piperazinepentanenitrile
Database identifiers
- PubChem CID
- 21999698
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 30.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 333
Related reactions
3 records
Compound notes
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