4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline

C25H19FN2 — CID 23851446

IUPAC4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline
SMILESFc1ccccc1/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C25H19FN2/c26-24-13-7-8-14-25(24)27-19-20-15-17-23(18-16-20)28(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-19H/b27-19+
InChIKeyVXMQWOBAIKNQQF-ZXVVBBHZSA-N
MW366.44 g/mol
LogP7.05
Rot. Bonds5

About 4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline

4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline (PubChem CID 23851446) has the molecular formula C25H19FN2 and a molecular weight of 366.44 g/mol. Its IUPAC name is 4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline.

Molecular Properties

Compound Name4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline
PubChem CID23851446
Molecular FormulaC25H19FN2
Molecular Weight366.44 g/mol
Exact Mass366.15
IUPAC Name4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline
SMILESFc1ccccc1/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C25H19FN2/c26-24-13-7-8-14-25(24)27-19-20-15-17-23(18-16-20)28(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-19H/b27-19+
InChIKeyVXMQWOBAIKNQQF-ZXVVBBHZSA-N
XLogP7.05
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.44
LogP ≤ 57.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline 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

N-(2-fluorophenyl)-1-(4-fluorophenyl)methanimine
CID 23329235
1-[4-(4-chlorophenyl)sulfanylphenyl]-N-(2-fluorophenyl)methanimine
CID 126074314
N,N-diphenyl-4-[(E)-2-[4-[(E)-2-[4-(N-[4-[(E)-2-[4-[(E)-2-[4-(N-[4-[(E)-2-[4-[(E)-2-[4-(N-[4-[(E)-2-[4-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]anilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]anilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]anilino)phenyl]ethenyl]phenyl]ethenyl]aniline
CID 177478696
1-N,1-N,4-N-triphenyl-4-N-[4-[2-[4-(N-phenylanilino)phenyl]ethenyl]phenyl]benzene-1,4-diamine
CID 66641192
N,N-diphenyl-4-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]aniline
CID 139195314
4-[[4-(N-phenylanilino)phenyl]methylideneamino]benzenesulfonamide
CID 25041425
N-phenyl-4-[(E)-[(E)-[4-(N-phenylanilino)phenyl]methylidenehydrazinylidene]methyl]aniline
CID 154979781
3-methyl-N-[4-[(4-methylphenyl)iminomethyl]phenyl]-N-phenylaniline
CID 22967567
4-[[3-fluoro-2-(trifluoromethyl)phenyl]iminomethyl]benzoic acid
CID 23333886
4-[(E)-2-(4-chlorophenyl)ethenyl]-N,N-diphenylaniline
CID 20650306
N-[4-[(diphenylhydrazinylidene)methyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 42614307
4-(naphthalen-2-yliminomethyl)-N,N-bis[4-(naphthalen-2-yliminomethyl)phenyl]aniline
CID 102053185

Frequently Asked Questions

What is the IUPAC name of 4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline?
The IUPAC name of 4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline (CID 23851446) is 4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline.
What is the SMILES notation for 4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline?
The canonical SMILES for 4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline is Fc1ccccc1/N=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline?
The InChIKey is VXMQWOBAIKNQQF-ZXVVBBHZSA-N. The full InChI is InChI=1S/C25H19FN2/c26-24-13-7-8-14-25(24)27-19-20-15-17-23(18-16-20)28(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-19H/b27-19+.
What are the key properties of 4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline?
4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline has a molecular weight of 366.44 g/mol, XLogP of 7.05, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-fluorophenyl)iminomethyl]-N,N-diphenylaniline is sourced from PubChem (CID 23851446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).