Basic information
- CAS
3965-86-4- Standard SMILES
Clc1ccccc1N1CCN(CCc2ccccn2)CC1- InChIKey
MDBYNIYDVXWNMS-UHFFFAOYSA-N- Molecular formula
- C17H20ClN3
- Average molar mass
- 301.8 g/mol
- Monoisotopic mass
- 301.1345753
Names & identifiers
- Preferred name
- Piperazine, 1-(o-chlorophenyl)-4-(2-(2-pyridyl)ethyl)-
- IUPAC
- 1-(2-chlorophenyl)-4-(2-pyridin-2-ylethyl)piperazine
Names & synonyms
Piperazine, 1-(o-chlorophenyl)-4-(2-(2-pyridyl)ethyl)-3965-86-4BRN 08934221-(o-Chlorophenyl)-4-(2-(2-pyridyl)ethyl)piperazinePiperazine, 1-(2-chlorophenyl)-4-(2-(2-pyridinyl)ethyl)-DTXSID201927591-(2-Chlorophenyl)-4-[2-(pyridin-2-yl)ethyl]piperazine
Database identifiers
- CAS
3965-86-4- PubChem CID
- 199285
- DTXSID
DTXSID20192759
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 19.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 304
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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