N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine

C13H7F4N — CID 23329282

IUPACN-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine
SMILESFc1cccc(/N=C/c2c(F)cc(F)cc2F)c1
InChIInChI=1S/C13H7F4N/c14-8-2-1-3-10(4-8)18-7-11-12(16)5-9(15)6-13(11)17/h1-7H/b18-7+
InChIKeyFGNZXVGORGGZEM-CNHKJKLMSA-N
MW253.20 g/mol
LogP3.99
Rot. Bonds2

About N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine

N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine (PubChem CID 23329282) has the molecular formula C13H7F4N and a molecular weight of 253.20 g/mol. Its IUPAC name is N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine.

Molecular Properties

Compound NameN-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine
PubChem CID23329282
Molecular FormulaC13H7F4N
Molecular Weight253.20 g/mol
Exact Mass253.05
IUPAC NameN-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine
SMILESFc1cccc(/N=C/c2c(F)cc(F)cc2F)c1
InChIInChI=1S/C13H7F4N/c14-8-2-1-3-10(4-8)18-7-11-12(16)5-9(15)6-13(11)17/h1-7H/b18-7+
InChIKeyFGNZXVGORGGZEM-CNHKJKLMSA-N
XLogP3.99
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.20
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(3-fluorophenyl)-1-(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

Related Compounds

1-(2,3-difluorophenyl)-N-(3-fluorophenyl)methanimine
CID 23329229
N-(2-methylsulfonylphenyl)-1-(2,4,6-trifluorophenyl)methanimine
CID 54275662
3-[(3-fluorophenyl)iminomethyl]benzonitrile
CID 139246020
(2,4,6-trifluorophenyl)methylidenehydrazine
CID 66926379
(NE)-N-[(2,4,6-trifluorophenyl)methylidene]hydroxylamine
CID 171366265
N-(3-fluorophenyl)-1-(1-phenylpyrrol-3-yl)methanimine
CID 50854962
N-(3-fluorophenyl)-1-(1-propan-2-ylpyrrol-3-yl)methanimine
CID 50853782
N-(3-fluorophenyl)-1-(5-methyl-1-phenylpyrrol-2-yl)methanimine
CID 50856275
1-(2,5-difluorophenyl)-N-phenylmethanimine
CID 23340889
2-[4-[(3-fluorophenyl)iminomethyl]phenoxy]acetamide
CID 23732371
N-(2,4-difluorophenyl)-1-(2,3,4,5,6-pentafluorophenyl)methanimine
CID 23278103
1-fluoro-3-(sulfonylamino)benzene
CID 151719875

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine?
The IUPAC name of N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine (CID 23329282) is N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine.
What is the SMILES notation for N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine?
The canonical SMILES for N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine is Fc1cccc(/N=C/c2c(F)cc(F)cc2F)c1.
What is the InChIKey of N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine?
The InChIKey is FGNZXVGORGGZEM-CNHKJKLMSA-N. The full InChI is InChI=1S/C13H7F4N/c14-8-2-1-3-10(4-8)18-7-11-12(16)5-9(15)6-13(11)17/h1-7H/b18-7+.
What are the key properties of N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine?
N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine has a molecular weight of 253.20 g/mol, XLogP of 3.99, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine is sourced from PubChem (CID 23329282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).