2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine

C10H15F6NO — CID 102722251

IUPAC2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine
SMILESFC(F)(F)C(OCCC1CCCCN1)C(F)(F)F
InChIInChI=1S/C10H15F6NO/c11-9(12,13)8(10(14,15)16)18-6-4-7-3-1-2-5-17-7/h7-8,17H,1-6H2
InChIKeyVCQFCJILAKKVSM-UHFFFAOYSA-N
MW279.22 g/mol
LogP3.03
Rot. Bonds4

About 2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine

2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine (PubChem CID 102722251) has the molecular formula C10H15F6NO and a molecular weight of 279.22 g/mol. Its IUPAC name is 2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine.

Molecular Properties

Compound Name2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine
PubChem CID102722251
Molecular FormulaC10H15F6NO
Molecular Weight279.22 g/mol
Exact Mass279.11
IUPAC Name2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine
SMILESFC(F)(F)C(OCCC1CCCCN1)C(F)(F)F
InChIInChI=1S/C10H15F6NO/c11-9(12,13)8(10(14,15)16)18-6-4-7-3-1-2-5-17-7/h7-8,17H,1-6H2
InChIKeyVCQFCJILAKKVSM-UHFFFAOYSA-N
XLogP3.03
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.22
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine?
The IUPAC name of 2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine (CID 102722251) is 2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine.
What is the SMILES notation for 2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine?
The canonical SMILES for 2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine is FC(F)(F)C(OCCC1CCCCN1)C(F)(F)F.
What is the InChIKey of 2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine?
The InChIKey is VCQFCJILAKKVSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F6NO/c11-9(12,13)8(10(14,15)16)18-6-4-7-3-1-2-5-17-7/h7-8,17H,1-6H2.
What are the key properties of 2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine?
2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine has a molecular weight of 279.22 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine is sourced from PubChem (CID 102722251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).