2-(methoxymethyl)-5-(trifluoromethyl)morpholine

C7H12F3NO2 — CID 167149185

IUPAC2-(methoxymethyl)-5-(trifluoromethyl)morpholine
SMILESCOCC1CNC(C(F)(F)F)CO1
InChIInChI=1S/C7H12F3NO2/c1-12-3-5-2-11-6(4-13-5)7(8,9)10/h5-6,11H,2-4H2,1H3
InChIKeyGZVJXBYNQOYMPI-UHFFFAOYSA-N
MW199.17 g/mol
LogP0.55
Rot. Bonds2

About 2-(methoxymethyl)-5-(trifluoromethyl)morpholine

2-(methoxymethyl)-5-(trifluoromethyl)morpholine (PubChem CID 167149185) has the molecular formula C7H12F3NO2 and a molecular weight of 199.17 g/mol. Its IUPAC name is 2-(methoxymethyl)-5-(trifluoromethyl)morpholine.

Molecular Properties

Compound Name2-(methoxymethyl)-5-(trifluoromethyl)morpholine
PubChem CID167149185
Molecular FormulaC7H12F3NO2
Molecular Weight199.17 g/mol
Exact Mass199.08
IUPAC Name2-(methoxymethyl)-5-(trifluoromethyl)morpholine
SMILESCOCC1CNC(C(F)(F)F)CO1
InChIInChI=1S/C7H12F3NO2/c1-12-3-5-2-11-6(4-13-5)7(8,9)10/h5-6,11H,2-4H2,1H3
InChIKeyGZVJXBYNQOYMPI-UHFFFAOYSA-N
XLogP0.55
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.17
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-5-(trifluoromethyl)morpholine?
The IUPAC name of 2-(methoxymethyl)-5-(trifluoromethyl)morpholine (CID 167149185) is 2-(methoxymethyl)-5-(trifluoromethyl)morpholine.
What is the SMILES notation for 2-(methoxymethyl)-5-(trifluoromethyl)morpholine?
The canonical SMILES for 2-(methoxymethyl)-5-(trifluoromethyl)morpholine is COCC1CNC(C(F)(F)F)CO1.
What is the InChIKey of 2-(methoxymethyl)-5-(trifluoromethyl)morpholine?
The InChIKey is GZVJXBYNQOYMPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F3NO2/c1-12-3-5-2-11-6(4-13-5)7(8,9)10/h5-6,11H,2-4H2,1H3.
What are the key properties of 2-(methoxymethyl)-5-(trifluoromethyl)morpholine?
2-(methoxymethyl)-5-(trifluoromethyl)morpholine has a molecular weight of 199.17 g/mol, XLogP of 0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-5-(trifluoromethyl)morpholine is sourced from PubChem (CID 167149185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).