Basic information
- CAS
58013-16-4- Standard SMILES
c1ccc(N2CCN(CCc3cccnc3)CC2)cc1- InChIKey
TXYVGFBIJKAUAP-UHFFFAOYSA-N- Molecular formula
- C17H21N3
- Average molar mass
- 267.37 g/mol
- Monoisotopic mass
- 267.17354768
Names & identifiers
- Preferred name
- Piperazine, 1-phenyl-4-(2-(3-pyridyl)ethyl)-
- IUPAC
- 1-phenyl-4-(2-pyridin-3-ylethyl)piperazine
Names & synonyms
Piperazine, 1-phenyl-4-(2-(3-pyridyl)ethyl)-1-(2-(3'-Pyridyl)ethyl)-4-(phenyl)piperazine1-(2-(3'-Piridil)etil)-4-(fenil)piperazina [Italian]58013-16-41-(2-(3'-Piridil)etil)-4-(fenil)piperazinaDTXSID40206741RefChem:372625DTXCID701292321-phenyl-4-[2-(pyridin-3-yl)ethyl]piperazine
Database identifiers
- CAS
58013-16-4- PubChem CID
- 3045008
- DTXSID
DTXSID40206741- Nikkaji
- J77.304B
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 19.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 267
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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