Basic information
- CAS
917902-99-9- Standard SMILES
c1cc(OCCCN2CCCCC2)cc(C2=NCCC2)c1- InChIKey
RUDRCXQGLQCJMR-UHFFFAOYSA-N- Molecular formula
- C18H26N2O
- Average molar mass
- 286.4 g/mol
- Monoisotopic mass
- 286.20451346
Names & identifiers
- Preferred name
- 1-{3-[3-(3,4-Dihydro-2H-pyrrol-5-yl)phenoxy]propyl}piperidine
- IUPAC
- 1-[3-[3-(3,4-dihydro-2H-pyrrol-5-yl)phenoxy]propyl]piperidine
Names & synonyms
917902-99-9SCHEMBL2810108DTXSID60737481RUDRCXQGLQCJMR-UHFFFAOYSA-N1-{3-[3-(3,4-Dihydro-2H-pyrrol-5-yl)phenoxy]propyl}piperidine1-{3-[3-(4,5-Dihydro-3H-pyrrol-2-yl)-phenoxy]-propyl}-piperidine
Database identifiers
- CAS
917902-99-9- PubChem CID
- 67543500
- DTXSID
DTXSID60737481
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 24.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 336
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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