Basic information
- Standard SMILES
CC[C@H]1CC[C@H](NCc2cc3c(nc2OC)CCC(=O)N3C)[C@H](c2ccccc2)N1- InChIKey
IYTRKIYNYOPXMT-LEDOBFOHSA-N- Molecular formula
- C24H32N4O2
- Average molar mass
- 408.5 g/mol
Names & identifiers
- Preferred name
- 7-[(6(S)-ethyl-2(S)-phenyl-piperidin-3(S)-ylamino)-methyl]-6-methoxy-1-methyl-3,4-dihydro-1H-[1,5]naphthyridin-2-one
- IUPAC
- 7-[[[(2S,3S,6S)-6-ethyl-2-phenylpiperidin-3-yl]amino]methyl]-6-methoxy-1-methyl-3,4-dihydro-1,5-naphthyridin-2-one
Names & synonyms
SCHEMBL6073599IYTRKIYNYOPXMT-LEDOBFOHSA-N7-[(6(S)-ethyl-2(S)-phenyl-piperidin-3(S)-ylamino)-methyl]-6-methoxy-1-methyl-3,4-dihydro-1H-[1,5]naphthyridin-2-one
Database identifiers
- PubChem CID
- 21069335
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 567
Related reactions
1 records
Compound notes
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