1-(2-(2-Quinolinylamino)ethyl)-4-(2-methoxyphenyl)piperazine
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Basic information
- Standard SMILES
COc1ccccc1N1CCN(CCNc2ccc3ccccc3n2)CC1- InChIKey
ISKNGKGHADBDHL-UHFFFAOYSA-N- Molecular formula
- C22H26N4O
- Average molar mass
- 362.5 g/mol
Names & identifiers
- Preferred name
- 1-(2-(2-Quinolinylamino)ethyl)-4-(2-methoxyphenyl)piperazine
- IUPAC
- N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]quinolin-2-amine
Names & synonyms
CHEMBL259887SCHEMBL8011275ISKNGKGHADBDHL-UHFFFAOYSA-NBDBM503739031-(2-(2-Quinolinylamino)ethyl)-4-(2-methoxyphenyl)piperazine
Database identifiers
- PubChem CID
- 23290959
- ChEMBL
CHEMBL259887
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 40.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 440
Related reactions
2 records
Compound notes
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