Benzenamine, 4-(2,3,4,4a,5,9b-hexahydro-1-methyl-1H-indeno(1,2-b)pyridin-5-yl)-, (4a-alpha,5-beta,9b-alpha)-
Basic information
- CAS
88763-09-1- Standard SMILES
CN1CCC[C@@H]2[C@H](c3ccc(N)cc3)c3ccccc3[C@@H]21- InChIKey
OKNQPPQXEDUWAI-QRVBRYPASA-N- Molecular formula
- C19H22N2
- Average molar mass
- 278.4 g/mol
- Monoisotopic mass
- 278.17829871
Names & identifiers
- Preferred name
- Benzenamine, 4-(2,3,4,4a,5,9b-hexahydro-1-methyl-1H-indeno(1,2-b)pyridin-5-yl)-, (4a-alpha,5-beta,9b-alpha)-
- IUPAC
- 4-[(4aR,5R,9bR)-1-methyl-2,3,4,4a,5,9b-hexahydroindeno[1,2-b]pyridin-5-yl]aniline
Names & synonyms
88763-09-1Benzenamine, 4-(2,3,4,4a,5,9b-hexahydro-1-methyl-1H-indeno(1,2-b)pyridin-5-yl)-, (4a-alpha,5-beta,9b-alpha)-DTXSID00237298RefChem:322865DTXCID001597894-[(4aR,5R,9bR)-1-Methyl-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-5-yl]aniline
Database identifiers
- CAS
88763-09-1- PubChem CID
- 3033733
- DTXSID
DTXSID00237298
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 361
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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