N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine

C19H13BrFN — CID 22031937

IUPACN-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine
SMILESFc1ccc(Br)cc1N=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H13BrFN/c20-16-11-12-17(21)18(13-16)22-19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13H
InChIKeyKQNUSSBHQJASAH-UHFFFAOYSA-N
MW354.22 g/mol
LogP5.76
Rot. Bonds3

About N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine

N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine (PubChem CID 22031937) has the molecular formula C19H13BrFN and a molecular weight of 354.22 g/mol. Its IUPAC name is N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine.

Molecular Properties

Compound NameN-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine
PubChem CID22031937
Molecular FormulaC19H13BrFN
Molecular Weight354.22 g/mol
Exact Mass353.02
IUPAC NameN-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine
SMILESFc1ccc(Br)cc1N=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H13BrFN/c20-16-11-12-17(21)18(13-16)22-19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13H
InChIKeyKQNUSSBHQJASAH-UHFFFAOYSA-N
XLogP5.76
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.22
LogP ≤ 55.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine 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 N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine?
The IUPAC name of N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine (CID 22031937) is N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine.
What is the SMILES notation for N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine?
The canonical SMILES for N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine is Fc1ccc(Br)cc1N=C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine?
The InChIKey is KQNUSSBHQJASAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13BrFN/c20-16-11-12-17(21)18(13-16)22-19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13H.
What are the key properties of N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine?
N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine has a molecular weight of 354.22 g/mol, XLogP of 5.76, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-fluorophenyl)-1,1-diphenylmethanimine is sourced from PubChem (CID 22031937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).