Indole, 3-(1-benzyl-4-piperidylmethyl)-5-methoxy-, hydrochloride
Basic information
- CAS
3515-59-1- Standard SMILES
COc1ccc2[nH]cc(CC3CC[NH+](Cc4ccccc4)CC3)c2c1.[Cl-]- InChIKey
DXNPDPHLCZRDFG-UHFFFAOYSA-N- Molecular formula
- C22H27ClN2O
- Average molar mass
- 370.9 g/mol
- Monoisotopic mass
- 370.1811912
Names & identifiers
- Preferred name
- Indole, 3-(1-benzyl-4-piperidylmethyl)-5-methoxy-, hydrochloride
- IUPAC
- 3-[(1-benzylpiperidin-1-ium-4-yl)methyl]-5-methoxy-1H-indole chloride
Names & synonyms
5-Methoxy-3-(N-benzyl-4-piperidinomethyl)indole hydrochloride3515-59-1INDOLE, 3-(1-BENZYL-4-PIPERIDYLMETHYL)-5-METHOXY-, HYDROCHLORIDERefChem:349197
Database identifiers
- CAS
3515-59-1- PubChem CID
- 19030
Properties
Computed structural properties
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 401
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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