1-{[(2S)-1-(phenylmethyl)-2-pyrrolidinyl]methyl}piperidine
Basic information
- Standard SMILES
c1ccc(CN2CCC[C@H]2CN2CCCCC2)cc1- InChIKey
CGWUQBDYGOJJCG-KRWDZBQOSA-N- Molecular formula
- C17H26N2
- Average molar mass
- 258.4 g/mol
Names & identifiers
- Preferred name
- 1-{[(2S)-1-(phenylmethyl)-2-pyrrolidinyl]methyl}piperidine
- IUPAC
- 1-[[(2S)-1-benzylpyrrolidin-2-yl]methyl]piperidine
Names & synonyms
SCHEMBL1191327CGWUQBDYGOJJCG-KRWDZBQOSA-N1-{[(2S)-1-(phenylmethyl)-2-pyrrolidinyl]methyl}piperidine
Database identifiers
- PubChem CID
- 66936746
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 254
Related reactions
2 records
Compound notes
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