Piperidine, 1-(2-(3-pyridyl)ethyl)-
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Basic information
- CAS
13450-66-3- Standard SMILES
c1cncc(CCN2CCCCC2)c1- InChIKey
CUYAYRDAKAKHLZ-UHFFFAOYSA-N- Molecular formula
- C12H18N2
- Average molar mass
- 190.28 g/mol
- Monoisotopic mass
- 190.14699858
Names & identifiers
- Preferred name
- Piperidine, 1-(2-(3-pyridyl)ethyl)-
- IUPAC
- 3-(2-piperidin-1-ylethyl)pyridine
- English name
- Piperidine, 1-(2-(3-pyridyl)ethyl)-
- Molecular formula
- C12H18N2
- Molecular weight
- 190.28
Names & synonyms
13450-66-3Piperidine, 1-(2-(3-pyridyl)ethyl)-3-(2-Piperidinoethyl)pyridineBRN 04748171-(2-(3-Pyridyl)ethyl)piperidineDTXSID601587535-22-09-00394 (Beilstein Handbook Reference)RefChem:372953DTXCID20812443-(2-(Piperidin-1-yl)ethyl)pyridine3-(2-piperidin-1-ylethyl)pyridine3-[2-(piperidin-1-yl)ethyl]pyridine
Show more names
Pyridine, 3-[2-(1-piperidinyl)ethyl]-
3(N-piperidylethyl)pyridinepyridine, 3-(piperidinoethyl)-SCHEMBL14304417SB42747
Database identifiers
- CAS
13450-66-3- PubChem CID
- 83475
- DTXSID
DTXSID60158753- Nikkaji
- J1.574.998I
Properties
Computed structural propertiesFilling in
- XLogP
- 1.7
- Topological polar surface area
- 16.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 152
Experimental & physicochemical properties
LogP1.66
Physicochemical properties
- Boiling point
- 102 · 102-103 °C(Press: 0.8 Torr)
- Density
- 1.006 · 1.006±0.06 g/cm3(Predicted)
- pka
- 9.02 · 9.02±0.10(Predicted)
- EWG's Food Scores
- 1 · 1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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