2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine

C8H15F3N2O — CID 28583018

IUPAC2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine
SMILESFC(F)(F)CNCCN1CCOCC1
InChIInChI=1S/C8H15F3N2O/c9-8(10,11)7-12-1-2-13-3-5-14-6-4-13/h12H,1-7H2
InChIKeyCNLFTWPXRAVBSV-UHFFFAOYSA-N
MW212.21 g/mol
LogP0.47
Rot. Bonds4

About 2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine

2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine (PubChem CID 28583018) has the molecular formula C8H15F3N2O and a molecular weight of 212.21 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine
PubChem CID28583018
Molecular FormulaC8H15F3N2O
Molecular Weight212.21 g/mol
Exact Mass212.11
IUPAC Name2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine
SMILESFC(F)(F)CNCCN1CCOCC1
InChIInChI=1S/C8H15F3N2O/c9-8(10,11)7-12-1-2-13-3-5-14-6-4-13/h12H,1-7H2
InChIKeyCNLFTWPXRAVBSV-UHFFFAOYSA-N
XLogP0.47
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine?
The IUPAC name of 2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine (CID 28583018) is 2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine.
What is the SMILES notation for 2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine?
The canonical SMILES for 2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine is FC(F)(F)CNCCN1CCOCC1.
What is the InChIKey of 2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine?
The InChIKey is CNLFTWPXRAVBSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2O/c9-8(10,11)7-12-1-2-13-3-5-14-6-4-13/h12H,1-7H2.
What are the key properties of 2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine?
2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine has a molecular weight of 212.21 g/mol, XLogP of 0.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(2-morpholin-4-ylethyl)ethanamine is sourced from PubChem (CID 28583018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).