Basic information
- CAS
107035-11-0- Standard SMILES
Nc1ccc([C@@H]2c3ccccc3[C@H]3NCCC[C@@H]23)cc1- InChIKey
WRODVCIVODHZFB-RCCFBDPRSA-N- Molecular formula
- C18H20N2
- Average molar mass
- 264.4 g/mol
- Monoisotopic mass
- 264.16264865
Names & identifiers
- Preferred name
- 1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-(4-aminophenyl)-, (+)-
- IUPAC
- 4-[(4aS,5R,9bS)-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-5-yl]aniline
Names & synonyms
1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-(4-aminophenyl)-, (+)-RefChem:1058142BRN 6065660(+)-2,3,4,4a,5,9b-Hexahydro-5-(4-aminophenyl)-1H-indeno(1,2-b)pyridine107035-11-0CHEMBL136718(+)-5-(4-Aminophenyl)-2,3,4,4a,5,9b-hexahydro-1H-indeno(1,2-b)pyridine
Database identifiers
- CAS
107035-11-0- PubChem CID
- 55849
- ChEMBL
CHEMBL136718
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 334
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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