Basic information
- Standard SMILES
C#CC(=Nc1ccc(OC)cc1)N1CCN(Cc2ccc(C)cc2)CC1- InChIKey
TVAKUUKPBSCEQG-UHFFFAOYSA-N- Molecular formula
- C22H25N3O
- Average molar mass
- 347.5 g/mol
Names & identifiers
- Preferred name
- 4-Methoxyphenylimino-3-[4-(4-methylbenzyl)-1-piperazinyl]propyne
- IUPAC
- N-(4-methoxyphenyl)-1-[4-[(4-methylphenyl)methyl]piperazin-1-yl]prop-2-yn-1-imine
Names & synonyms
TVAKUUKPBSCEQG-UHFFFAOYSA-N4-methoxyphenylimino-3-[4-(4-methylbenzyl)-1-piperazinyl]propyne
Database identifiers
- PubChem CID
- 86743013
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 28.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 499
Related reactions
1 records
Compound notes
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