2-(2,2,2-trifluoroethoxymethyl)piperidine

C8H14F3NO — CID 24702991

IUPAC2-(2,2,2-trifluoroethoxymethyl)piperidine
SMILESFC(F)(F)COCC1CCCCN1
InChIInChI=1S/C8H14F3NO/c9-8(10,11)6-13-5-7-3-1-2-4-12-7/h7,12H,1-6H2
InChIKeyVSGBOLKIDNZNTJ-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.71
Rot. Bonds3

About 2-(2,2,2-trifluoroethoxymethyl)piperidine

2-(2,2,2-trifluoroethoxymethyl)piperidine (PubChem CID 24702991) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is 2-(2,2,2-trifluoroethoxymethyl)piperidine.

Molecular Properties

Compound Name2-(2,2,2-trifluoroethoxymethyl)piperidine
PubChem CID24702991
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC Name2-(2,2,2-trifluoroethoxymethyl)piperidine
SMILESFC(F)(F)COCC1CCCCN1
InChIInChI=1S/C8H14F3NO/c9-8(10,11)6-13-5-7-3-1-2-4-12-7/h7,12H,1-6H2
InChIKeyVSGBOLKIDNZNTJ-UHFFFAOYSA-N
XLogP1.71
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4,4,4-trifluorobutoxymethyl)pyrrolidine
CID 115514545
(2R)-2-(4,4,4-trifluorobutoxymethyl)pyrrolidine
CID 102820223
2-(ethoxymethyl)azepane
CID 79569846
1-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]methanesulfonamide
CID 63827272
2-(2-propoxyethoxymethyl)piperidine
CID 63684377
N-(pyrrolidin-2-ylmethyl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 106638477
1-piperidin-2-yl-N-(2,2,2-trifluoroethoxy)propan-2-amine
CID 82711010
2-(cyclohexylmethoxymethyl)pyrrolidine
CID 62335288
(2S)-2-(cyclopropylmethoxymethyl)pyrrolidine
CID 59651686
(2R)-2-(cyclopropylmethoxymethyl)pyrrolidine
CID 102820123
2-(2-methylprop-2-enoxymethyl)piperidine
CID 62339397
2-(oxan-4-ylmethoxymethyl)piperidine
CID 62383000

Frequently Asked Questions

What is the IUPAC name of 2-(2,2,2-trifluoroethoxymethyl)piperidine?
The IUPAC name of 2-(2,2,2-trifluoroethoxymethyl)piperidine (CID 24702991) is 2-(2,2,2-trifluoroethoxymethyl)piperidine.
What is the SMILES notation for 2-(2,2,2-trifluoroethoxymethyl)piperidine?
The canonical SMILES for 2-(2,2,2-trifluoroethoxymethyl)piperidine is FC(F)(F)COCC1CCCCN1.
What is the InChIKey of 2-(2,2,2-trifluoroethoxymethyl)piperidine?
The InChIKey is VSGBOLKIDNZNTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c9-8(10,11)6-13-5-7-3-1-2-4-12-7/h7,12H,1-6H2.
What are the key properties of 2-(2,2,2-trifluoroethoxymethyl)piperidine?
2-(2,2,2-trifluoroethoxymethyl)piperidine has a molecular weight of 197.20 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2,2-trifluoroethoxymethyl)piperidine is sourced from PubChem (CID 24702991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).