Basic information
- CAS
101274-87-7- Standard SMILES
CCC1CCN(Cc2c[nH]c3ccccc23)CC1- InChIKey
JZCGJWATOJNJGP-UHFFFAOYSA-N- Molecular formula
- C16H22N2
- Average molar mass
- 242.36 g/mol
- Monoisotopic mass
- 242.17829871
Names & identifiers
- Preferred name
- Indole, 3-((4-ethylpiperidino)methyl)-
- IUPAC
- 3-[(4-ethylpiperidin-1-yl)methyl]-1H-indole
Names & synonyms
INDOLE, 3-((4-ETHYLPIPERIDINO)METHYL)-101274-87-7BRN 01969423-[(4-ethylpiperidin-1-yl)methyl]-1H-indole3-((4-Ethylpiperidino)methyl)indoleCHEMBL5599423SCHEMBL13040506DTXSID60143821
Database identifiers
- CAS
101274-87-7- PubChem CID
- 58244
- DTXSID
DTXSID60143821- ChEMBL
CHEMBL5599423
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 19 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 258
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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