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

C10H15F6NO — CID 59204102

IUPAC1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine
SMILESFC(F)(F)C(OCCN1CCCCC1)C(F)(F)F
InChIInChI=1S/C10H15F6NO/c11-9(12,13)8(10(14,15)16)18-7-6-17-4-2-1-3-5-17/h8H,1-7H2
InChIKeyJRSJMTHEZSEMCK-UHFFFAOYSA-N
MW279.22 g/mol
LogP2.98
Rot. Bonds4

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

1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine (PubChem CID 59204102) has the molecular formula C10H15F6NO and a molecular weight of 279.22 g/mol. Its IUPAC name is 1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine.

Molecular Properties

Compound Name1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine
PubChem CID59204102
Molecular FormulaC10H15F6NO
Molecular Weight279.22 g/mol
Exact Mass279.11
IUPAC Name1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine
SMILESFC(F)(F)C(OCCN1CCCCC1)C(F)(F)F
InChIInChI=1S/C10H15F6NO/c11-9(12,13)8(10(14,15)16)18-7-6-17-4-2-1-3-5-17/h8H,1-7H2
InChIKeyJRSJMTHEZSEMCK-UHFFFAOYSA-N
XLogP2.98
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.22
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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1-(2-ethoxyethyl)piperidine
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1-[2-[bis(4-fluorophenyl)methoxy]ethyl]pyrrolidine;hydrochloride
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1-[2-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]oxyethyl]piperidine
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Frequently Asked Questions

What is the IUPAC name of 1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine?
The IUPAC name of 1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine (CID 59204102) is 1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine.
What is the SMILES notation for 1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine?
The canonical SMILES for 1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine is FC(F)(F)C(OCCN1CCCCC1)C(F)(F)F.
What is the InChIKey of 1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine?
The InChIKey is JRSJMTHEZSEMCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F6NO/c11-9(12,13)8(10(14,15)16)18-7-6-17-4-2-1-3-5-17/h8H,1-7H2.
What are the key properties of 1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine?
1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine has a molecular weight of 279.22 g/mol, XLogP of 2.98, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine is sourced from PubChem (CID 59204102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).