Basic information
- Standard SMILES
CCOCc1nc2c(N)nc(C)c(C)c2n1CCC1CCN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)CC1- InChIKey
XNQGJVLBCFTLMO-XZOQPEGZSA-N- Molecular formula
- C28H38N6O2
- Average molar mass
- 490.6 g/mol
- Monoisotopic mass
- 490.30562448
Names & identifiers
- Preferred name
- 4-{2-[4-amino-2-(ethoxymethyl)-6,7-dimethyl-1H-imidazo[4,5-c]pyridin-1-yl]ethyl}-N-[(1R*,2S*)-2-phenylcyclopropyl]piperidine-1-carboxamide
- IUPAC
- 4-[2-[4-amino-2-(ethoxymethyl)-6,7-dimethylimidazo[4,5-c]pyridin-1-yl]ethyl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide
Names & synonyms
SCHEMBL6288252XNQGJVLBCFTLMO-XZOQPEGZSA-N4-{2-[4-amino-2-(ethoxymethyl)-6,7-dimethyl-1H-imidazo[4,5-c]pyridin-1-yl]ethyl}-N-[(1R*,2S*)-2-phenylcyclopropyl]piperidine-1-carboxamide
Database identifiers
- PubChem CID
- 20575808
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 98.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 725
Related reactions
3 records
Compound notes
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