3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine

C11H20F3NO2 — CID 55064528

IUPAC3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine
SMILESFC(F)(F)COCCOCCC1CCCNC1
InChIInChI=1S/C11H20F3NO2/c12-11(13,14)9-17-7-6-16-5-3-10-2-1-4-15-8-10/h10,15H,1-9H2
InChIKeySVDSFGLLGVDBSL-UHFFFAOYSA-N
MW255.28 g/mol
LogP1.97
Rot. Bonds7

About 3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine

3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine (PubChem CID 55064528) has the molecular formula C11H20F3NO2 and a molecular weight of 255.28 g/mol. Its IUPAC name is 3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine.

Molecular Properties

Compound Name3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine
PubChem CID55064528
Molecular FormulaC11H20F3NO2
Molecular Weight255.28 g/mol
Exact Mass255.14
IUPAC Name3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine
SMILESFC(F)(F)COCCOCCC1CCCNC1
InChIInChI=1S/C11H20F3NO2/c12-11(13,14)9-17-7-6-16-5-3-10-2-1-4-15-8-10/h10,15H,1-9H2
InChIKeySVDSFGLLGVDBSL-UHFFFAOYSA-N
XLogP1.97
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride
CID 56829882
3-[2-(2-butoxyethoxy)ethyl]piperidine
CID 62357528
3-[2-(2-propoxyethoxy)ethyl]piperidine;hydrochloride
CID 56830022
2-(2-piperidin-3-ylethoxy)ethanol
CID 104680589
N-(piperidin-3-ylmethyl)-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropanamine
CID 106640104
3-[2-(cyclobutylmethoxy)ethyl]piperidine
CID 56830620
2,2-dimethyl-3-(2-piperidin-3-ylethoxy)propanoic acid
CID 106939866
3-[2-(3-methylbutoxy)ethyl]piperidine
CID 53409519
(3R)-3-[2-(3-methylbutoxy)ethyl]piperidine
CID 86320703
3-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]azepane
CID 104680798
3-[2-(methoxymethoxy)ethyl]piperidine
CID 106938134
3-[2-(2-pyrrolidin-1-ylethoxy)ethyl]piperidine
CID 62356152

Frequently Asked Questions

What is the IUPAC name of 3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine?
The IUPAC name of 3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine (CID 55064528) is 3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine.
What is the SMILES notation for 3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine?
The canonical SMILES for 3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine is FC(F)(F)COCCOCCC1CCCNC1.
What is the InChIKey of 3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine?
The InChIKey is SVDSFGLLGVDBSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO2/c12-11(13,14)9-17-7-6-16-5-3-10-2-1-4-15-8-10/h10,15H,1-9H2.
What are the key properties of 3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine?
3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine has a molecular weight of 255.28 g/mol, XLogP of 1.97, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethyl]piperidine is sourced from PubChem (CID 55064528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).