(E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine

C15H9F6NO — CID 11151742

IUPAC(E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine
SMILESFC(F)(F)c1ccccc1/C=N/Oc1ccccc1C(F)(F)F
InChIInChI=1S/C15H9F6NO/c16-14(17,18)11-6-2-1-5-10(11)9-22-23-13-8-4-3-7-12(13)15(19,20)21/h1-9H/b22-9+
InChIKeyRMFHFAWSZWLEQP-LSFURLLWSA-N
MW333.23 g/mol
LogP5.14
Rot. Bonds3

About (E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine

(E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine (PubChem CID 11151742) has the molecular formula C15H9F6NO and a molecular weight of 333.23 g/mol. Its IUPAC name is (E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine.

Molecular Properties

Compound Name(E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine
PubChem CID11151742
Molecular FormulaC15H9F6NO
Molecular Weight333.23 g/mol
Exact Mass333.06
IUPAC Name(E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine
SMILESFC(F)(F)c1ccccc1/C=N/Oc1ccccc1C(F)(F)F
InChIInChI=1S/C15H9F6NO/c16-14(17,18)11-6-2-1-5-10(11)9-22-23-13-8-4-3-7-12(13)15(19,20)21/h1-9H/b22-9+
InChIKeyRMFHFAWSZWLEQP-LSFURLLWSA-N
XLogP5.14
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.23
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine 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 (E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine?
The IUPAC name of (E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine (CID 11151742) is (E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine.
What is the SMILES notation for (E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine?
The canonical SMILES for (E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine is FC(F)(F)c1ccccc1/C=N/Oc1ccccc1C(F)(F)F.
What is the InChIKey of (E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine?
The InChIKey is RMFHFAWSZWLEQP-LSFURLLWSA-N. The full InChI is InChI=1S/C15H9F6NO/c16-14(17,18)11-6-2-1-5-10(11)9-22-23-13-8-4-3-7-12(13)15(19,20)21/h1-9H/b22-9+.
What are the key properties of (E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine?
(E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine has a molecular weight of 333.23 g/mol, XLogP of 5.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[2-(trifluoromethyl)phenoxy]-1-[2-(trifluoromethyl)phenyl]methanimine is sourced from PubChem (CID 11151742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).