Basic information
- Standard SMILES
CN(C)C1(Cc2ccccc2)CCC(NCc2c[nH]c3ccccc23)CC1.Cl.Cl- InChIKey
QQDBYNAPOFMHOC-UHFFFAOYSA-N- Molecular formula
- C24H33Cl2N3
- Average molar mass
- 434.4 g/mol
- Monoisotopic mass
- 433.2051535
Names & identifiers
- Preferred name
- 1-benzyl-N'-(1H-indol-3-ylmethyl)-N,N-dimethylcyclohexane-1,4-diamine dihydrochloride
- IUPAC
- 1-benzyl-4-N-(1H-indol-3-ylmethyl)-1-N,1-N-dimethylcyclohexane-1,4-diamine;dihydrochloride
Names & synonyms
SCHEMBL5164262QQDBYNAPOFMHOC-UHFFFAOYSA-N1-benzyl-N'-(1H-indol-3-ylmethyl)-N,N-dimethylcyclohexane-1,4-diamine dihydrochloride
Database identifiers
- PubChem CID
- 69337296
Properties
Computed structural properties
- Topological polar surface area
- 31.1 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 449
Related reactions
1 records
Compound notes
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