4-[4-(trifluoromethyl)phenoxy]piperidine

C12H14F3NO — CID 3688392

IUPAC4-[4-(trifluoromethyl)phenoxy]piperidine
SMILESFC(F)(F)c1ccc(OC2CCNCC2)cc1
InChIInChI=1S/C12H14F3NO/c13-12(14,15)9-1-3-10(4-2-9)17-11-5-7-16-8-6-11/h1-4,11,16H,5-8H2
InChIKeyHRYZQEDCGWRROX-UHFFFAOYSA-N
MW245.24 g/mol
LogP2.84
Rot. Bonds2

About 4-[4-(trifluoromethyl)phenoxy]piperidine

4-[4-(trifluoromethyl)phenoxy]piperidine (PubChem CID 3688392) has the molecular formula C12H14F3NO and a molecular weight of 245.24 g/mol. Its IUPAC name is 4-[4-(trifluoromethyl)phenoxy]piperidine.

Molecular Properties

Compound Name4-[4-(trifluoromethyl)phenoxy]piperidine
PubChem CID3688392
Molecular FormulaC12H14F3NO
Molecular Weight245.24 g/mol
Exact Mass245.10
IUPAC Name4-[4-(trifluoromethyl)phenoxy]piperidine
SMILESFC(F)(F)c1ccc(OC2CCNCC2)cc1
InChIInChI=1S/C12H14F3NO/c13-12(14,15)9-1-3-10(4-2-9)17-11-5-7-16-8-6-11/h1-4,11,16H,5-8H2
InChIKeyHRYZQEDCGWRROX-UHFFFAOYSA-N
XLogP2.84
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.24
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(trifluoromethyl)phenoxy]piperidine?
The IUPAC name of 4-[4-(trifluoromethyl)phenoxy]piperidine (CID 3688392) is 4-[4-(trifluoromethyl)phenoxy]piperidine.
What is the SMILES notation for 4-[4-(trifluoromethyl)phenoxy]piperidine?
The canonical SMILES for 4-[4-(trifluoromethyl)phenoxy]piperidine is FC(F)(F)c1ccc(OC2CCNCC2)cc1.
What is the InChIKey of 4-[4-(trifluoromethyl)phenoxy]piperidine?
The InChIKey is HRYZQEDCGWRROX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F3NO/c13-12(14,15)9-1-3-10(4-2-9)17-11-5-7-16-8-6-11/h1-4,11,16H,5-8H2.
What are the key properties of 4-[4-(trifluoromethyl)phenoxy]piperidine?
4-[4-(trifluoromethyl)phenoxy]piperidine has a molecular weight of 245.24 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(trifluoromethyl)phenoxy]piperidine is sourced from PubChem (CID 3688392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).