Basic information
- CAS
5099-78-5- Standard SMILES
NC(=O)N1CCC2(c3ccccc3)CC1Cc1ccc(O)cc12- InChIKey
CQBUYEUMRLNDEY-UHFFFAOYSA-N- Molecular formula
- C19H20N2O2
- Average molar mass
- 308.4 g/mol
- Monoisotopic mass
- 308.15247789
Names & identifiers
- Preferred name
- 8-Hydroxy-6-phenyl-1,4,5,6-tetrahydro-2,6-methano-3-benzazocine-3(2H)-carboximidic acid
- IUPAC
- 4-hydroxy-1-phenyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-triene-10-carboxamide
Names & synonyms
DTXSID609652628-Hydroxy-6-phenyl-1,4,5,6-tetrahydro-2,6-methano-3-benzazocine-3(2H)-carboximidic acid
Database identifiers
- CAS
5099-78-5- PubChem CID
- 199847
- DTXSID
DTXSID60965262- Nikkaji
- J62.571J
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 462
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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