Basic information
- CAS
745-80-2- Standard SMILES
CCOC(CCN1CCN(c2cccc(C)c2)CC1)c1ccccc1- InChIKey
CBAIGJQVUIEMCP-UHFFFAOYSA-N- Molecular formula
- C22H30N2O
- Average molar mass
- 338.5 g/mol
- Monoisotopic mass
- 338.23581359
Names & identifiers
- Preferred name
- 1-(3-Ethoxy-3-phenylpropyl)-4-(3-methylphenyl)piperazine
- IUPAC
- 1-(3-ethoxy-3-phenylpropyl)-4-(3-methylphenyl)piperazine
Names & synonyms
L6G2K736BK1-(3-ethoxy-3-phenylpropyl)-4-(3-methylphenyl)piperazineUNII-L6G2K736BK1-(3-Ethoxy-3-phenylpropyl)-4-(3-tolyl)-piperazine745-80-2Piperazine, 1-(3-ethoxy-3-phenylpropyl)-4-(3-methylphenyl)-
Database identifiers
- CAS
745-80-2- PubChem CID
- 13329
- UNII
- L6G2K736BK
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 15.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 361
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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