Basic information
- Standard SMILES
NC(=O)c1cncc(NC(=O)COc2ccc(C34CC5CC(CC(C5)C3)C4)cc2)c1- InChIKey
RNKGSWWPDQQSGF-UHFFFAOYSA-N- Molecular formula
- C24H27N3O3
- Average molar mass
- 405.5 g/mol
Names & identifiers
- Preferred name
- 5-[2-(4-Adamantan-1-yl-phenoxy)-acetylamino]-nicotinamide
- IUPAC
- 5-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]pyridine-3-carboxamide
Names & synonyms
CHEMBL4013905-[2-(4-adamantan-1-yl-phenoxy)-acetylamino]-nicotinamideSCHEMBL4293545RNKGSWWPDQQSGF-UHFFFAOYSA-NBDBM50222815
Database identifiers
- PubChem CID
- 44443262
- ChEMBL
CHEMBL401390
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 94.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 617
Related reactions
1 records
Compound notes
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