Basic information
- CAS
57529-82-5- Standard SMILES
CN(C)CCc1cc2cccc3c2n1-c1ccccc1CC3- InChIKey
USFSFSBGCYFTQG-UHFFFAOYSA-N- Molecular formula
- C20H22N2
- Average molar mass
- 290.4 g/mol
- Monoisotopic mass
- 290.17829871
Names & identifiers
- Preferred name
- Indolo(1,7-ab)(1)benzazepine-1-ethanamine, 6,7-dihydro-N,N-dimethyl-
- IUPAC
- 2-(1-azatetracyclo[8.6.1.02,7.014,17]heptadeca-2,4,6,10,12,14(17),15-heptaen-16-yl)-N,N-dimethylethanamine
Names & synonyms
BRN 0425069INDOLO(1,7-ab)(1)BENZAZEPINE-1-ETHANAMINE, 6,7-DIHYDRO-N,N-DIMETHYL-57529-82-5DTXSID402061406,7-Dihydro-N,N-dimethyl-indolo(1,7-ab)(1)benzazepine-1-ethanamineRefChem:349400DTXCID40128631CHEMBL32735542-(6,7-Dihydroindolo[1,7-ab][1]benzazepin-1-yl)-N,N-dimethylethan-1-amine
Database identifiers
- CAS
57529-82-5- PubChem CID
- 42397
- DTXSID
DTXSID40206140- ChEMBL
CHEMBL3273554
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 8.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 380
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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