4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine

C15H20F3NO2 — CID 20735346

IUPAC4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine
SMILESFC(F)(F)COCc1ccc(COC2CCNCC2)cc1
InChIInChI=1S/C15H20F3NO2/c16-15(17,18)11-20-9-12-1-3-13(4-2-12)10-21-14-5-7-19-8-6-14/h1-4,14,19H,5-11H2
InChIKeyFGHWOOKYTGSSEZ-UHFFFAOYSA-N
MW303.32 g/mol
LogP3.03
Rot. Bonds6

About 4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine

4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine (PubChem CID 20735346) has the molecular formula C15H20F3NO2 and a molecular weight of 303.32 g/mol. Its IUPAC name is 4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine.

Molecular Properties

Compound Name4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine
PubChem CID20735346
Molecular FormulaC15H20F3NO2
Molecular Weight303.32 g/mol
Exact Mass303.14
IUPAC Name4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine
SMILESFC(F)(F)COCc1ccc(COC2CCNCC2)cc1
InChIInChI=1S/C15H20F3NO2/c16-15(17,18)11-20-9-12-1-3-13(4-2-12)10-21-14-5-7-19-8-6-14/h1-4,14,19H,5-11H2
InChIKeyFGHWOOKYTGSSEZ-UHFFFAOYSA-N
XLogP3.03
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.32
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 65774
2-Phenylmorpholine
CID 91101
2-(4-(Benzyloxy)piperidin-1-yl)-N-methylethanamine
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N-(cyclohexylmethyl)-2-[(2S,6R)-6-phenyloxan-2-yl]ethanamine
CID 164625324
4-Phenyl-4-(4-trifluoromethyl-benzyloxymethyl)-piperidine
CID 19960248
4-Benzyloxymethyl-piperidine
CID 6484121
Flumexadol HCl
CID 208046
4-(Benzyloxy)piperidine
CID 3157460
2-Phenylmorpholine hydrochloride
CID 12343539
Flumetramide
CID 23512
4-[1-(4-Fluorophenyl)ethoxy]-1-methylpiperidine
CID 44404583
(1S,5R)-3-phenylmethoxy-3-[4-(trifluoromethyl)phenyl]-8-azabicyclo[3.2.1]octane
CID 76316944

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine?
The IUPAC name of 4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine (CID 20735346) is 4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine.
What is the SMILES notation for 4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine?
The canonical SMILES for 4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine is FC(F)(F)COCc1ccc(COC2CCNCC2)cc1.
What is the InChIKey of 4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine?
The InChIKey is FGHWOOKYTGSSEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F3NO2/c16-15(17,18)11-20-9-12-1-3-13(4-2-12)10-21-14-5-7-19-8-6-14/h1-4,14,19H,5-11H2.
What are the key properties of 4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine?
4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine has a molecular weight of 303.32 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methoxy]piperidine is sourced from PubChem (CID 20735346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).