3-(2,2,2-trifluoroethyl)morpholine

C6H10F3NO — CID 83914474

IUPAC3-(2,2,2-trifluoroethyl)morpholine
SMILESFC(F)(F)CC1COCCN1
InChIInChI=1S/C6H10F3NO/c7-6(8,9)3-5-4-11-2-1-10-5/h5,10H,1-4H2
InChIKeyFFPWJEVAPQZFFW-UHFFFAOYSA-N
MW169.15 g/mol
LogP0.93
Rot. Bonds1

About 3-(2,2,2-trifluoroethyl)morpholine

3-(2,2,2-trifluoroethyl)morpholine (PubChem CID 83914474) has the molecular formula C6H10F3NO and a molecular weight of 169.15 g/mol. Its IUPAC name is 3-(2,2,2-trifluoroethyl)morpholine.

Molecular Properties

Compound Name3-(2,2,2-trifluoroethyl)morpholine
PubChem CID83914474
Molecular FormulaC6H10F3NO
Molecular Weight169.15 g/mol
Exact Mass169.07
IUPAC Name3-(2,2,2-trifluoroethyl)morpholine
SMILESFC(F)(F)CC1COCCN1
InChIInChI=1S/C6H10F3NO/c7-6(8,9)3-5-4-11-2-1-10-5/h5,10H,1-4H2
InChIKeyFFPWJEVAPQZFFW-UHFFFAOYSA-N
XLogP0.93
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.15
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Ethylmorpholine
CID 14267782
(S)-3-Ethylmorpholine
CID 28064334
3-(2,2-Difluoroethyl)morpholine
CID 119030882
N-(2,2,2-trifluoroethyl)oxan-3-amine
CID 63363393
3-(Fluoromethyl)morpholine hydrochloride
CID 22342647
3-Ethylmorpholine--hydrogen chloride (1/1)
CID 22342764
2-(Trifluoromethyl)morpholine hydrochloride
CID 53534844
(3R)-3-fluoromethylmorpholine
CID 54445403
3-(Trifluoromethyl)morpholine hydrochloride
CID 54594823
2-Methyl-6-(trifluoromethyl)morpholine
CID 63901303
(3S)-3-Ethylmorpholine hydrochloride
CID 67094181
(2S)-2-(trifluoromethyl)morpholine hydrochloride
CID 68285203

Frequently Asked Questions

What is the IUPAC name of 3-(2,2,2-trifluoroethyl)morpholine?
The IUPAC name of 3-(2,2,2-trifluoroethyl)morpholine (CID 83914474) is 3-(2,2,2-trifluoroethyl)morpholine.
What is the SMILES notation for 3-(2,2,2-trifluoroethyl)morpholine?
The canonical SMILES for 3-(2,2,2-trifluoroethyl)morpholine is FC(F)(F)CC1COCCN1.
What is the InChIKey of 3-(2,2,2-trifluoroethyl)morpholine?
The InChIKey is FFPWJEVAPQZFFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3NO/c7-6(8,9)3-5-4-11-2-1-10-5/h5,10H,1-4H2.
What are the key properties of 3-(2,2,2-trifluoroethyl)morpholine?
3-(2,2,2-trifluoroethyl)morpholine has a molecular weight of 169.15 g/mol, XLogP of 0.93, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2,2-trifluoroethyl)morpholine is sourced from PubChem (CID 83914474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).