3-fluoro-2,2,6,6-tetramethylpiperidine

C9H18FN — CID 153382728

IUPAC3-fluoro-2,2,6,6-tetramethylpiperidine
SMILESCC1(C)CCC(F)C(C)(C)N1
InChIInChI=1S/C9H18FN/c1-8(2)6-5-7(10)9(3,4)11-8/h7,11H,5-6H2,1-4H3
InChIKeyWCXVEQHJRSGQJK-UHFFFAOYSA-N
MW159.25 g/mol
LogP2.27
Rot. Bonds

About 3-fluoro-2,2,6,6-tetramethylpiperidine

3-fluoro-2,2,6,6-tetramethylpiperidine (PubChem CID 153382728) has the molecular formula C9H18FN and a molecular weight of 159.25 g/mol. Its IUPAC name is 3-fluoro-2,2,6,6-tetramethylpiperidine.

Molecular Properties

Compound Name3-fluoro-2,2,6,6-tetramethylpiperidine
PubChem CID153382728
Molecular FormulaC9H18FN
Molecular Weight159.25 g/mol
Exact Mass159.14
IUPAC Name3-fluoro-2,2,6,6-tetramethylpiperidine
SMILESCC1(C)CCC(F)C(C)(C)N1
InChIInChI=1S/C9H18FN/c1-8(2)6-5-7(10)9(3,4)11-8/h7,11H,5-6H2,1-4H3
InChIKeyWCXVEQHJRSGQJK-UHFFFAOYSA-N
XLogP2.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.25
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2,6,6-Tetramethylpiperidine
CID 13035
Piperidine, 2,2,6,6-tetramethyl-, hydrobromide
CID 120464
Piperidine, 2,2,6,6-tetramethyl-, hydrochloride (1:1)
CID 120465
2,2,6,6-Tetramethylpiperidine--hydrogen iodide (1/1)
CID 120466
Piperidine, 2,2,4,6,6-pentamethyl-
CID 3048078
piperidine, 2,2,6,6-tetramethyl-, lithium salt
CID 57419888
2,2,6,6-Tetramethylpiperidin-1-ium
CID 1550918
1,2,2,6,6-Pentamethylpiperidin-1-ium
CID 6989217
2-methyl-N-(2-methylbutan-2-yl)heptan-2-amine
CID 4228492
2,2,6,6-Tetramethyl-piperidine 1-oxide
CID 10125083
2,4,6-Trimethyl collidine
CID 15702294
2,2,6,6-Tetramethyl-4-iodopiperidine
CID 20671091

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2,2,6,6-tetramethylpiperidine?
The IUPAC name of 3-fluoro-2,2,6,6-tetramethylpiperidine (CID 153382728) is 3-fluoro-2,2,6,6-tetramethylpiperidine.
What is the SMILES notation for 3-fluoro-2,2,6,6-tetramethylpiperidine?
The canonical SMILES for 3-fluoro-2,2,6,6-tetramethylpiperidine is CC1(C)CCC(F)C(C)(C)N1.
What is the InChIKey of 3-fluoro-2,2,6,6-tetramethylpiperidine?
The InChIKey is WCXVEQHJRSGQJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FN/c1-8(2)6-5-7(10)9(3,4)11-8/h7,11H,5-6H2,1-4H3.
What are the key properties of 3-fluoro-2,2,6,6-tetramethylpiperidine?
3-fluoro-2,2,6,6-tetramethylpiperidine has a molecular weight of 159.25 g/mol, XLogP of 2.27, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2,2,6,6-tetramethylpiperidine is sourced from PubChem (CID 153382728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).