Basic information
- Standard SMILES
CCC(=O)Nc1cccc(CCN2CCN(c3cccc4nc(C)ccc34)CC2)c1- InChIKey
QDNMAHYHMXHIIS-UHFFFAOYSA-N- Molecular formula
- C25H30N4O
- Average molar mass
- 402.5 g/mol
Names & identifiers
- Preferred name
- N-(3-{2-[4-(2-Methyl-5-quinolinyl)-1-piperazinyl]ethyl}phenyl)propanamide
- IUPAC
- N-[3-[2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]phenyl]propanamide
Names & synonyms
SCHEMBL2882750CHEMBL1632207QDNMAHYHMXHIIS-UHFFFAOYSA-NN-(3-{2-[4-(2-Methyl-5-quinolinyl)-1-piperazinyl]ethyl}phenyl)propanamideN-(3-{2-[4-(2-Methyl-5-quinolinyl)-l-piperazinyl]ethyl}phenyl)propanamide
Database identifiers
- PubChem CID
- 49852001
- ChEMBL
CHEMBL1632207
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 48.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 547
Related reactions
5 records
Linked notes
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