2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine

C11H20F3N — CID 102438016

IUPAC2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine
SMILESCC1(C)CCCC(C)(C)N1CC(F)(F)F
InChIInChI=1S/C11H20F3N/c1-9(2)6-5-7-10(3,4)15(9)8-11(12,13)14/h5-8H2,1-4H3
InChIKeyDOGOYPQBLIJIFG-UHFFFAOYSA-N
MW223.28 g/mol
LogP3.59
Rot. Bonds1

About 2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine

2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine (PubChem CID 102438016) has the molecular formula C11H20F3N and a molecular weight of 223.28 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine
PubChem CID102438016
Molecular FormulaC11H20F3N
Molecular Weight223.28 g/mol
Exact Mass223.15
IUPAC Name2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine
SMILESCC1(C)CCCC(C)(C)N1CC(F)(F)F
InChIInChI=1S/C11H20F3N/c1-9(2)6-5-7-10(3,4)15(9)8-11(12,13)14/h5-8H2,1-4H3
InChIKeyDOGOYPQBLIJIFG-UHFFFAOYSA-N
XLogP3.59
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Pempidine
CID 6603
Piperidine, 1-ethyl-2,2,6,6-tetramethyl-
CID 122564
Pempidine hydrochloride
CID 201521
1,2,2,6-Tetramethylpiperidine
CID 23423758
2,2,6,6-Tetramethyl-1-(trifluoromethyl)piperidine
CID 15105668
N-(n-propyl)-2,2,6,6-tetramethylpiperidine
CID 18972211
1,2,2,6-Tetramethyl-6-methylpiperidine
CID 59068978
N-(dimethyloctyl)piperidine
CID 129763246
Piperidine, 1,2,2,6,6-pentamethyl-, hydriodide (1:1)
CID 113224
1,1,2,2,6,6-Hexamethylpiperidinium halide
CID 15657086
4,4-Difluoro-1-(4-methylpentyl)piperidine
CID 20811829
1-[1-(Trifluoromethyl)cyclohexyl]piperidine
CID 54169363

Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine?
The IUPAC name of 2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine (CID 102438016) is 2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine.
What is the SMILES notation for 2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine?
The canonical SMILES for 2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine is CC1(C)CCCC(C)(C)N1CC(F)(F)F.
What is the InChIKey of 2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine?
The InChIKey is DOGOYPQBLIJIFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3N/c1-9(2)6-5-7-10(3,4)15(9)8-11(12,13)14/h5-8H2,1-4H3.
What are the key properties of 2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine?
2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine has a molecular weight of 223.28 g/mol, XLogP of 3.59, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-1-(2,2,2-trifluoroethyl)piperidine is sourced from PubChem (CID 102438016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).