5H-Dibenz(b,f)azepine, 5-(2-(diethylamino)ethyl)-10,11-dihydro-
Basic information
- CAS
2095-90-1- Standard SMILES
CCN(CC)CCN1c2ccccc2CCc2ccccc21- InChIKey
BIBNMUJJPRRCJS-UHFFFAOYSA-N- Molecular formula
- C20H26N2
- Average molar mass
- 294.4 g/mol
- Monoisotopic mass
- 294.20959884
Names & identifiers
- Preferred name
- 5H-Dibenz(b,f)azepine, 5-(2-(diethylamino)ethyl)-10,11-dihydro-
- IUPAC
- 2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-diethylethanamine
Names & synonyms
BRN 02626885H-Dibenz(b,f)azepine, 5-(2-(diethylamino)ethyl)-10,11-dihydro-DTXSID901751302095-90-15H-Dibenz(b,f)azepine, 10,11-dihydro-5-(2-(diethylamino)ethyl)-4-20-00-03906 (Beilstein Handbook Reference)RefChem:305441DTXCID40976212-(10,11-Dihydro-5H-dibenzo[b,f]azepin-5-yl)-N,N-diethylethan-1-amine
Database identifiers
- CAS
2095-90-1- PubChem CID
- 74982
- DTXSID
DTXSID90175130- Nikkaji
- J40.870K
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 302
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Compound notes
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