Basic information
- CAS
57529-91-6- Standard SMILES
Cc1c(CN(C)C)c2cccc3c2n1-c1ccccc1CC3- InChIKey
PFPQXCTYSWOVRY-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-2-methanamine, 6,7-dihydro-N,N,1-trimethyl-
- IUPAC
- N,N-dimethyl-1-(16-methyl-1-azatetracyclo[8.6.1.02,7.014,17]heptadeca-2,4,6,10(17),11,13,15-heptaen-15-yl)methanamine
Names & synonyms
BRN 0490767INDOLO(1,7-ab)(1)BENZAZEPINE-2-METHANAMINE, 6,7-DIHYDRO-N,N,1-TRIMETHYL-57529-91-6DTXSID002061466,7-Dihydro-N,N,1-trimethyl-indolo(1,7-ab)(1)benzazepine-2-methanamineRefChem:349404DTXCID00128637CHEMBL3273563N,N-Dimethyl-1-(1-methyl-6,7-dihydroindolo[1,7-ab][1]benzazepin-2-yl)methanamine
Database identifiers
- CAS
57529-91-6- PubChem CID
- 42407
- DTXSID
DTXSID00206146- ChEMBL
CHEMBL3273563
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 8.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 393
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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