2-(trifluoromethoxy)piperidine

C6H10F3NO — CID 68572157

IUPAC2-(trifluoromethoxy)piperidine
SMILESFC(F)(F)OC1CCCCN1
InChIInChI=1S/C6H10F3NO/c7-6(8,9)11-5-3-1-2-4-10-5/h5,10H,1-4H2
InChIKeyKMYABAFAQUCBQX-UHFFFAOYSA-N
MW169.15 g/mol
LogP1.62
Rot. Bonds1

About 2-(trifluoromethoxy)piperidine

2-(trifluoromethoxy)piperidine (PubChem CID 68572157) has the molecular formula C6H10F3NO and a molecular weight of 169.15 g/mol. Its IUPAC name is 2-(trifluoromethoxy)piperidine.

Molecular Properties

Compound Name2-(trifluoromethoxy)piperidine
PubChem CID68572157
Molecular FormulaC6H10F3NO
Molecular Weight169.15 g/mol
Exact Mass169.07
IUPAC Name2-(trifluoromethoxy)piperidine
SMILESFC(F)(F)OC1CCCCN1
InChIInChI=1S/C6H10F3NO/c7-6(8,9)11-5-3-1-2-4-10-5/h5,10H,1-4H2
InChIKeyKMYABAFAQUCBQX-UHFFFAOYSA-N
XLogP1.62
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.15
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethoxy)piperidine?
The IUPAC name of 2-(trifluoromethoxy)piperidine (CID 68572157) is 2-(trifluoromethoxy)piperidine.
What is the SMILES notation for 2-(trifluoromethoxy)piperidine?
The canonical SMILES for 2-(trifluoromethoxy)piperidine is FC(F)(F)OC1CCCCN1.
What is the InChIKey of 2-(trifluoromethoxy)piperidine?
The InChIKey is KMYABAFAQUCBQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3NO/c7-6(8,9)11-5-3-1-2-4-10-5/h5,10H,1-4H2.
What are the key properties of 2-(trifluoromethoxy)piperidine?
2-(trifluoromethoxy)piperidine has a molecular weight of 169.15 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethoxy)piperidine is sourced from PubChem (CID 68572157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).