1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine

C10H10F7N — CID 101266096

IUPAC1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine
SMILESFC1=C(N2CCCCC2)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C10H10F7N/c11-6-7(18-4-2-1-3-5-18)9(14,15)10(16,17)8(6,12)13/h1-5H2
InChIKeyHXXGFJQDZDHQMD-UHFFFAOYSA-N
MW277.18 g/mol
LogP3.57
Rot. Bonds1

About 1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine

1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine (PubChem CID 101266096) has the molecular formula C10H10F7N and a molecular weight of 277.18 g/mol. Its IUPAC name is 1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine.

Molecular Properties

Compound Name1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine
PubChem CID101266096
Molecular FormulaC10H10F7N
Molecular Weight277.18 g/mol
Exact Mass277.07
IUPAC Name1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine
SMILESFC1=C(N2CCCCC2)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C10H10F7N/c11-6-7(18-4-2-1-3-5-18)9(14,15)10(16,17)8(6,12)13/h1-5H2
InChIKeyHXXGFJQDZDHQMD-UHFFFAOYSA-N
XLogP3.57
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.18
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine?
The IUPAC name of 1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine (CID 101266096) is 1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine.
What is the SMILES notation for 1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine?
The canonical SMILES for 1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine is FC1=C(N2CCCCC2)C(F)(F)C(F)(F)C1(F)F.
What is the InChIKey of 1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine?
The InChIKey is HXXGFJQDZDHQMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F7N/c11-6-7(18-4-2-1-3-5-18)9(14,15)10(16,17)8(6,12)13/h1-5H2.
What are the key properties of 1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine?
1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine has a molecular weight of 277.18 g/mol, XLogP of 3.57, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)piperidine is sourced from PubChem (CID 101266096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).