Completing data — refresh the page later to see the latest
Basic information
- CAS
57529-86-9- Standard SMILES
Cc1c(CCN(C)C)n2c3c(cccc13)CCc1ccccc1-2- InChIKey
TZGIJHSIMPTQSE-UHFFFAOYSA-N- Molecular formula
- C21H24N2
- Average molar mass
- 304.4 g/mol
- Monoisotopic mass
- 304.19394877
Names & identifiers
- Preferred name
- Indolo(1,7-ab)(1)benzazepine-1-ethanamine, 6,7-dihydro-N,N,2-trimethyl-
- IUPAC
- N,N-dimethyl-2-(15-methyl-1-azatetracyclo[8.6.1.02,7.014,17]heptadeca-2,4,6,10(17),11,13,15-heptaen-16-yl)ethanamine
Names & synonyms
BRN 0491501INDOLO(1,7-ab)(1)BENZAZEPINE-1-ETHANAMINE, 6,7-DIHYDRO-N,N,2-TRIMETHYL-57529-86-9DTXSID602061426,7-Dihydro-N,N-2-trimethyl-indolo(1,7-ab)(1)benzazepine-1-ethanamineRefChem:349398DTXCID60128633CHEMBL3273557TZGIJHSIMPTQSE-UHFFFAOYSA-N1-(2-dimethylaminoethyl)-6,7-dihydro-2-methylindolo[1,7-ab][1]benzazepineN,N-Dimethyl-2-(2-methyl-6,7-dihydroindolo[1,7-ab][1]benzazepin-1-yl)ethan-1-amine
Database identifiers
- CAS
57529-86-9- PubChem CID
- 42402
- DTXSID
DTXSID60206142- ChEMBL
CHEMBL3273557
Properties
Computed structural propertiesFilling in
- XLogP
- 4.7
- Topological polar surface area
- 8.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 407
Related reactions
2 records
Compound notes
Loading…