Basic information
- Standard SMILES
Nc1cc2ccc(C3CCNCC3)cc2nc1C(=O)Nc1cnccc1N1CCC[C@H](N)C1- InChIKey
AMNYMLVTVLXRTN-IBGZPJMESA-N- Molecular formula
- C25H31N7O
- Average molar mass
- 445.6 g/mol
- Monoisotopic mass
- 445.25900864
Names & identifiers
- Preferred name
- 3-Amino-N-{4-[(3S)-3-aminopiperidin-1-yl]pyridin-3-yl}-7-piperidin-4-ylquinoline-2-carboxamide
- IUPAC
- 3-amino-N-[4-[(3S)-3-aminopiperidin-1-yl]-3-pyridinyl]-7-piperidin-4-ylquinoline-2-carboxamide
Names & synonyms
SCHEMBL15873375AMNYMLVTVLXRTN-IBGZPJMESA-N3-Amino-N-{4-[(3S)-3-aminopiperidin-1-yl]pyridin-3-yl}-7-piperidin-4-ylquinoline-2-carboxamide
Database identifiers
- PubChem CID
- 77844147
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 657
Related reactions
1 records
Compound notes
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