4-Piperidinone, 1-benzyl-3-((2-ethyl-1H-indol-3-yl)methyl)-
Basic information
- CAS
37125-97-6- Standard SMILES
CCc1[nH]c2ccccc2c1CC1CN(Cc2ccccc2)CCC1=O- InChIKey
WNWCECVCVRZVRO-UHFFFAOYSA-N- Molecular formula
- C23H26N2O
- Average molar mass
- 346.5 g/mol
- Monoisotopic mass
- 346.20451346
Names & identifiers
- Preferred name
- 4-Piperidinone, 1-benzyl-3-((2-ethyl-1H-indol-3-yl)methyl)-
- IUPAC
- 1-benzyl-3-[(2-ethyl-1H-indol-3-yl)methyl]piperidin-4-one
Names & synonyms
ICIG 865BRN 089815937125-97-64-Piperidinone, 1-benzyl-3-((2-ethyl-1H-indol-3-yl)methyl)-N-Benzyl-3-(2'-ethyl-3'-indolyl)methyl-4-piperidone5-24-03-00580 (Beilstein Handbook Reference)RefChem:2959051-benzyl-3-[(2-ethyl-1h-indol-3-yl)methyl]piperidin-4-oneDTXSID50958305
Database identifiers
- CAS
37125-97-6- PubChem CID
- 216141
- DTXSID
DTXSID50958305- Nikkaji
- J126.053G
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 36.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 473
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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