Basic information
- CAS
121784-56-3- Standard SMILES
CN(C)C1CCc2ccc3[nH]ccc3c2C1- InChIKey
HENBLLXAHPTGHX-UHFFFAOYSA-N- Molecular formula
- C14H18N2
- Average molar mass
- 214.31 g/mol
- Monoisotopic mass
- 214.14699858
Overview
RN & structure given in first source; RN given refers to (+-)-isomer; RN for cpd without isomeric designation not available 10/89; has central dopamine & serotonin receptor stimulating properties
Names & identifiers
- Preferred name
- 6,7,8,9-tetrahydro-N,N-dimethyl-3H-benz(e)indol-8-amine
- IUPAC
- N,N-dimethyl-6,7,8,9-tetrahydro-3H-benzo[e]indol-8-amine
- English name
- 6,7,8,9-tetrahydro-N,N-dimethyl-3H-benz(e)indol-8-amine
- Molecular weight
- 0
Names & synonyms
TDBIA121784-56-36,7,8,9-Tetrahydro-N,N-dimethyl-3H-benz(e)indol-8-amineRefChem:103786N,N-dimethyl-6,7,8,9-tetrahydro-3H-benzo[e]indol-8-amineCHEMBL413105SCHEMBL3201298DTXSID50923957HENBLLXAHPTGHX-UHFFFAOYSA-NBDBM5001752083343-46-8L005581
Show more names
Dimethyl-(6,7,8,9-tetrahydro-3H-benzo[e]indol-8-yl)-amine(+/-)-Dimethyl-(6,7,8,9-tetrahydro-3H-benzo[e]indol-8-yl)-amine3H-Benz(e)indol-8-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-, (+-)-
Database identifiers
- CAS
121784-56-3- PubChem CID
- 129503
- DTXSID
DTXSID50923957- ChEMBL
CHEMBL413105- Nikkaji
- J879.794C
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 19 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 251
Related reactions
3 records
Compound notes
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