4-ethyl-2-(trifluoromethyl)morpholine

C7H12F3NO — CID 89019106

IUPAC4-ethyl-2-(trifluoromethyl)morpholine
SMILESCCN1CCOC(C(F)(F)F)C1
InChIInChI=1S/C7H12F3NO/c1-2-11-3-4-12-6(5-11)7(8,9)10/h6H,2-5H2,1H3
InChIKeyWXPLZWYGCNEPGQ-UHFFFAOYSA-N
MW183.17 g/mol
LogP1.27
Rot. Bonds1

About 4-ethyl-2-(trifluoromethyl)morpholine

4-ethyl-2-(trifluoromethyl)morpholine (PubChem CID 89019106) has the molecular formula C7H12F3NO and a molecular weight of 183.17 g/mol. Its IUPAC name is 4-ethyl-2-(trifluoromethyl)morpholine.

Molecular Properties

Compound Name4-ethyl-2-(trifluoromethyl)morpholine
PubChem CID89019106
Molecular FormulaC7H12F3NO
Molecular Weight183.17 g/mol
Exact Mass183.09
IUPAC Name4-ethyl-2-(trifluoromethyl)morpholine
SMILESCCN1CCOC(C(F)(F)F)C1
InChIInChI=1S/C7H12F3NO/c1-2-11-3-4-12-6(5-11)7(8,9)10/h6H,2-5H2,1H3
InChIKeyWXPLZWYGCNEPGQ-UHFFFAOYSA-N
XLogP1.27
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(trifluoromethyl)morpholine?
The IUPAC name of 4-ethyl-2-(trifluoromethyl)morpholine (CID 89019106) is 4-ethyl-2-(trifluoromethyl)morpholine.
What is the SMILES notation for 4-ethyl-2-(trifluoromethyl)morpholine?
The canonical SMILES for 4-ethyl-2-(trifluoromethyl)morpholine is CCN1CCOC(C(F)(F)F)C1.
What is the InChIKey of 4-ethyl-2-(trifluoromethyl)morpholine?
The InChIKey is WXPLZWYGCNEPGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F3NO/c1-2-11-3-4-12-6(5-11)7(8,9)10/h6H,2-5H2,1H3.
What are the key properties of 4-ethyl-2-(trifluoromethyl)morpholine?
4-ethyl-2-(trifluoromethyl)morpholine has a molecular weight of 183.17 g/mol, XLogP of 1.27, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(trifluoromethyl)morpholine is sourced from PubChem (CID 89019106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).