6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one

C8H9F6NO2 — CID 102190774

IUPAC6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one
SMILESO=C1CCCC(OC(C(F)(F)F)C(F)(F)F)N1
InChIInChI=1S/C8H9F6NO2/c9-7(10,11)6(8(12,13)14)17-5-3-1-2-4(16)15-5/h5-6H,1-3H2,(H,15,16)
InChIKeyQOZYSXAGYCYDSF-UHFFFAOYSA-N
MW265.15 g/mol
LogP2.12
Rot. Bonds2

About 6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one

6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one (PubChem CID 102190774) has the molecular formula C8H9F6NO2 and a molecular weight of 265.15 g/mol. Its IUPAC name is 6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one.

Molecular Properties

Compound Name6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one
PubChem CID102190774
Molecular FormulaC8H9F6NO2
Molecular Weight265.15 g/mol
Exact Mass265.05
IUPAC Name6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one
SMILESO=C1CCCC(OC(C(F)(F)F)C(F)(F)F)N1
InChIInChI=1S/C8H9F6NO2/c9-7(10,11)6(8(12,13)14)17-5-3-1-2-4(16)15-5/h5-6H,1-3H2,(H,15,16)
InChIKeyQOZYSXAGYCYDSF-UHFFFAOYSA-N
XLogP2.12
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.15
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Piperidinone, 6-ethoxy-
CID 12220376
6-Butoxypiperidin-2-one
CID 12502851
4,4-difluoro-5-propan-2-yloxy-N-(2,2,2-trifluoroethyl)pentanamide;molecular hydrogen
CID 157032971
4,4-difluoro-5-propan-2-yloxy-N-(2,2,2-trifluoroethyl)pentanamide
CID 157032972
N-(2,2,3,3,3-pentafluoropropyl)-5-propan-2-yloxypentanamide
CID 161360683
N-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)-5-propan-2-yloxypentanamide
CID 161360684

Frequently Asked Questions

What is the IUPAC name of 6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one?
The IUPAC name of 6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one (CID 102190774) is 6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one.
What is the SMILES notation for 6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one?
The canonical SMILES for 6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one is O=C1CCCC(OC(C(F)(F)F)C(F)(F)F)N1.
What is the InChIKey of 6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one?
The InChIKey is QOZYSXAGYCYDSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F6NO2/c9-7(10,11)6(8(12,13)14)17-5-3-1-2-4(16)15-5/h5-6H,1-3H2,(H,15,16).
What are the key properties of 6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one?
6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one has a molecular weight of 265.15 g/mol, XLogP of 2.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)piperidin-2-one is sourced from PubChem (CID 102190774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).