3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine

C13H16F3NO2 — CID 122357463

IUPAC3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine
SMILESFC(F)(F)Oc1cccc(COC2CCCNC2)c1
InChIInChI=1S/C13H16F3NO2/c14-13(15,16)19-11-4-1-3-10(7-11)9-18-12-5-2-6-17-8-12/h1,3-4,7,12,17H,2,5-6,8-9H2
InChIKeyRIMPBVFEBUIXJD-UHFFFAOYSA-N
MW275.27 g/mol
LogP2.85
Rot. Bonds4

About 3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine

3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine (PubChem CID 122357463) has the molecular formula C13H16F3NO2 and a molecular weight of 275.27 g/mol. Its IUPAC name is 3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine.

Molecular Properties

Compound Name3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine
PubChem CID122357463
Molecular FormulaC13H16F3NO2
Molecular Weight275.27 g/mol
Exact Mass275.11
IUPAC Name3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine
SMILESFC(F)(F)Oc1cccc(COC2CCCNC2)c1
InChIInChI=1S/C13H16F3NO2/c14-13(15,16)19-11-4-1-3-10(7-11)9-18-12-5-2-6-17-8-12/h1,3-4,7,12,17H,2,5-6,8-9H2
InChIKeyRIMPBVFEBUIXJD-UHFFFAOYSA-N
XLogP2.85
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.27
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(3-bromophenyl)methoxy]piperidine
CID 53409415
3-[(3-methoxyphenyl)methoxy]pyrrolidine
CID 20735282
N-methyl-1-piperidin-3-yl-N-[[3-(trifluoromethoxy)phenyl]methyl]methanamine
CID 103815912
2-phenyl-1-[3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidin-1-yl]ethanone
CID 42844188
N-methyl-N-[[3-(trifluoromethoxy)phenyl]methyl]piperidine-3-carboxamide;hydrochloride
CID 119345501
(3R)-3-[(3-methylphenyl)methoxy]pyrrolidine
CID 26191874
(3S)-3-[(3-fluoro-4-methoxyphenyl)methoxy]piperidine
CID 66247179
3-[(3-bromophenyl)methoxy]pyrrolidine;hydrochloride
CID 53409416
3-[(3-chlorophenyl)methoxy]pyrrolidine;hydrochloride
CID 45075467
tert-butyl formate;3-(naphthalen-2-ylmethoxy)piperidine
CID 174386816
2-fluoro-5-[[(3S)-piperidin-3-yl]oxymethyl]benzonitrile
CID 114012459
(4-chlorophenyl)-[(3S)-3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidin-1-yl]methanone
CID 93223787

Frequently Asked Questions

What is the IUPAC name of 3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine?
The IUPAC name of 3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine (CID 122357463) is 3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine.
What is the SMILES notation for 3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine?
The canonical SMILES for 3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine is FC(F)(F)Oc1cccc(COC2CCCNC2)c1.
What is the InChIKey of 3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine?
The InChIKey is RIMPBVFEBUIXJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F3NO2/c14-13(15,16)19-11-4-1-3-10(7-11)9-18-12-5-2-6-17-8-12/h1,3-4,7,12,17H,2,5-6,8-9H2.
What are the key properties of 3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine?
3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine has a molecular weight of 275.27 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[3-(trifluoromethoxy)phenyl]methoxy]piperidine is sourced from PubChem (CID 122357463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).