2,2,2-trifluoro-N-methoxy-N-methylethanamine

C4H8F3NO — CID 89311692

IUPAC2,2,2-trifluoro-N-methoxy-N-methylethanamine
SMILESCON(C)CC(F)(F)F
InChIInChI=1S/C4H8F3NO/c1-8(9-2)3-4(5,6)7/h3H2,1-2H3
InChIKeyOYZYDBYXRBZHNA-UHFFFAOYSA-N
MW143.11 g/mol
LogP1.04
Rot. Bonds2

About 2,2,2-trifluoro-N-methoxy-N-methylethanamine

2,2,2-trifluoro-N-methoxy-N-methylethanamine (PubChem CID 89311692) has the molecular formula C4H8F3NO and a molecular weight of 143.11 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-methoxy-N-methylethanamine.

Molecular Properties

Compound Name2,2,2-trifluoro-N-methoxy-N-methylethanamine
PubChem CID89311692
Molecular FormulaC4H8F3NO
Molecular Weight143.11 g/mol
Exact Mass143.06
IUPAC Name2,2,2-trifluoro-N-methoxy-N-methylethanamine
SMILESCON(C)CC(F)(F)F
InChIInChI=1S/C4H8F3NO/c1-8(9-2)3-4(5,6)7/h3H2,1-2H3
InChIKeyOYZYDBYXRBZHNA-UHFFFAOYSA-N
XLogP1.04
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.11
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2,2,2-trifluoro-N-methoxy-N-methylethanamine 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-methoxy-N-methylethanamine?
The IUPAC name of 2,2,2-trifluoro-N-methoxy-N-methylethanamine (CID 89311692) is 2,2,2-trifluoro-N-methoxy-N-methylethanamine.
What is the SMILES notation for 2,2,2-trifluoro-N-methoxy-N-methylethanamine?
The canonical SMILES for 2,2,2-trifluoro-N-methoxy-N-methylethanamine is CON(C)CC(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-methoxy-N-methylethanamine?
The InChIKey is OYZYDBYXRBZHNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8F3NO/c1-8(9-2)3-4(5,6)7/h3H2,1-2H3.
What are the key properties of 2,2,2-trifluoro-N-methoxy-N-methylethanamine?
2,2,2-trifluoro-N-methoxy-N-methylethanamine has a molecular weight of 143.11 g/mol, XLogP of 1.04, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-methoxy-N-methylethanamine is sourced from PubChem (CID 89311692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).