2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine

C6H9F6NO2 — CID 75406290

IUPAC2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine
SMILESFC(F)(F)OCCNCCOC(F)(F)F
InChIInChI=1S/C6H9F6NO2/c7-5(8,9)14-3-1-13-2-4-15-6(10,11)12/h13H,1-4H2
InChIKeyHCUDUAUFDNNYTA-UHFFFAOYSA-N
MW241.13 g/mol
LogP1.65
Rot. Bonds6

About 2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine

2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine (PubChem CID 75406290) has the molecular formula C6H9F6NO2 and a molecular weight of 241.13 g/mol. Its IUPAC name is 2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine.

Molecular Properties

Compound Name2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine
PubChem CID75406290
Molecular FormulaC6H9F6NO2
Molecular Weight241.13 g/mol
Exact Mass241.05
IUPAC Name2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine
SMILESFC(F)(F)OCCNCCOC(F)(F)F
InChIInChI=1S/C6H9F6NO2/c7-5(8,9)14-3-1-13-2-4-15-6(10,11)12/h13H,1-4H2
InChIKeyHCUDUAUFDNNYTA-UHFFFAOYSA-N
XLogP1.65
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.13
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine?
The IUPAC name of 2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine (CID 75406290) is 2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine.
What is the SMILES notation for 2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine?
The canonical SMILES for 2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine is FC(F)(F)OCCNCCOC(F)(F)F.
What is the InChIKey of 2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine?
The InChIKey is HCUDUAUFDNNYTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F6NO2/c7-5(8,9)14-3-1-13-2-4-15-6(10,11)12/h13H,1-4H2.
What are the key properties of 2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine?
2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine has a molecular weight of 241.13 g/mol, XLogP of 1.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)ethyl]ethanamine is sourced from PubChem (CID 75406290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).