1-(6,6,6-trifluorohexyl)piperidine

C11H20F3N — CID 71259183

IUPAC1-(6,6,6-trifluorohexyl)piperidine
SMILESFC(F)(F)CCCCCN1CCCCC1
InChIInChI=1S/C11H20F3N/c12-11(13,14)7-3-1-4-8-15-9-5-2-6-10-15/h1-10H2
InChIKeyPJBDTUXCFVKWRL-UHFFFAOYSA-N
MW223.28 g/mol
LogP3.60
Rot. Bonds5

About 1-(6,6,6-trifluorohexyl)piperidine

1-(6,6,6-trifluorohexyl)piperidine (PubChem CID 71259183) has the molecular formula C11H20F3N and a molecular weight of 223.28 g/mol. Its IUPAC name is 1-(6,6,6-trifluorohexyl)piperidine.

Molecular Properties

Compound Name1-(6,6,6-trifluorohexyl)piperidine
PubChem CID71259183
Molecular FormulaC11H20F3N
Molecular Weight223.28 g/mol
Exact Mass223.15
IUPAC Name1-(6,6,6-trifluorohexyl)piperidine
SMILESFC(F)(F)CCCCCN1CCCCC1
InChIInChI=1S/C11H20F3N/c12-11(13,14)7-3-1-4-8-15-9-5-2-6-10-15/h1-10H2
InChIKeyPJBDTUXCFVKWRL-UHFFFAOYSA-N
XLogP3.60
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(11,11-dimethyldodecyl)piperidine
CID 118887407
1-(6-piperidin-1-ylhexyl)piperidine bromide
CID 53351438
4,4,4-trifluoro-N-(3-pyrrolidin-1-ylpropyl)butan-1-amine
CID 115513697
3-methyl-1-(5,5,5-trifluoropentyl)-1,4-diazepane
CID 115522482
1-decylpiperidine
CID 4649960
1-octylazonane
CID 20533821
9-piperidin-1-ylnonan-1-amine
CID 123762077
7-(azepan-1-yl)heptan-1-amine
CID 28597448
1-dodecylazepane
CID 3366129
10-piperidin-1-yldecan-1-ol
CID 22218518
6-(azacyclotridec-1-yl)hexan-1-ol
CID 101161993
1-tetradecylpiperidine;hydrochloride
CID 71325293

Frequently Asked Questions

What is the IUPAC name of 1-(6,6,6-trifluorohexyl)piperidine?
The IUPAC name of 1-(6,6,6-trifluorohexyl)piperidine (CID 71259183) is 1-(6,6,6-trifluorohexyl)piperidine.
What is the SMILES notation for 1-(6,6,6-trifluorohexyl)piperidine?
The canonical SMILES for 1-(6,6,6-trifluorohexyl)piperidine is FC(F)(F)CCCCCN1CCCCC1.
What is the InChIKey of 1-(6,6,6-trifluorohexyl)piperidine?
The InChIKey is PJBDTUXCFVKWRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3N/c12-11(13,14)7-3-1-4-8-15-9-5-2-6-10-15/h1-10H2.
What are the key properties of 1-(6,6,6-trifluorohexyl)piperidine?
1-(6,6,6-trifluorohexyl)piperidine has a molecular weight of 223.28 g/mol, XLogP of 3.60, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6,6,6-trifluorohexyl)piperidine is sourced from PubChem (CID 71259183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).