(2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine

C14H10F3N — CID 143022568

IUPAC(2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine
SMILES[H]/N=C(\c1ccccc1C)c1c(F)cc(F)cc1F
InChIInChI=1S/C14H10F3N/c1-8-4-2-3-5-10(8)14(18)13-11(16)6-9(15)7-12(13)17/h2-7,18H,1H3/b18-14+
InChIKeyMUJRDSKGNWLRJW-NBVRZTHBSA-N
MW249.24 g/mol
LogP3.83
Rot. Bonds2

About (2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine

(2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine (PubChem CID 143022568) has the molecular formula C14H10F3N and a molecular weight of 249.24 g/mol. Its IUPAC name is (2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine.

Molecular Properties

Compound Name(2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine
PubChem CID143022568
Molecular FormulaC14H10F3N
Molecular Weight249.24 g/mol
Exact Mass249.08
IUPAC Name(2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine
SMILES[H]/N=C(\c1ccccc1C)c1c(F)cc(F)cc1F
InChIInChI=1S/C14H10F3N/c1-8-4-2-3-5-10(8)14(18)13-11(16)6-9(15)7-12(13)17/h2-7,18H,1H3/b18-14+
InChIKeyMUJRDSKGNWLRJW-NBVRZTHBSA-N
XLogP3.83
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.24
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (2-methylphenyl)-(2,4,6-trifluorophenyl)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 (2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine?
The IUPAC name of (2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine (CID 143022568) is (2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine.
What is the SMILES notation for (2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine?
The canonical SMILES for (2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine is [H]/N=C(\c1ccccc1C)c1c(F)cc(F)cc1F.
What is the InChIKey of (2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine?
The InChIKey is MUJRDSKGNWLRJW-NBVRZTHBSA-N. The full InChI is InChI=1S/C14H10F3N/c1-8-4-2-3-5-10(8)14(18)13-11(16)6-9(15)7-12(13)17/h2-7,18H,1H3/b18-14+.
What are the key properties of (2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine?
(2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine has a molecular weight of 249.24 g/mol, XLogP of 3.83, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylphenyl)-(2,4,6-trifluorophenyl)methanimine is sourced from PubChem (CID 143022568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).