N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine

C22H20FNO — CID 126221634

IUPACN-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine
SMILESCc1cccc(/N=C/c2ccccc2OCc2ccccc2F)c1C
InChIInChI=1S/C22H20FNO/c1-16-8-7-12-21(17(16)2)24-14-18-9-4-6-13-22(18)25-15-19-10-3-5-11-20(19)23/h3-14H,15H2,1-2H3/b24-14+
InChIKeyYQXQKZAXBCUYNM-ZVHZXABRSA-N
MW333.41 g/mol
LogP5.77
Rot. Bonds5

About N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine

N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine (PubChem CID 126221634) has the molecular formula C22H20FNO and a molecular weight of 333.41 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine
PubChem CID126221634
Molecular FormulaC22H20FNO
Molecular Weight333.41 g/mol
Exact Mass333.15
IUPAC NameN-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine
SMILESCc1cccc(/N=C/c2ccccc2OCc2ccccc2F)c1C
InChIInChI=1S/C22H20FNO/c1-16-8-7-12-21(17(16)2)24-14-18-9-4-6-13-22(18)25-15-19-10-3-5-11-20(19)23/h3-14H,15H2,1-2H3/b24-14+
InChIKeyYQXQKZAXBCUYNM-ZVHZXABRSA-N
XLogP5.77
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.41
LogP ≤ 55.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]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

Related Compounds

1-[3-chloro-4-[(2-fluorophenyl)methoxy]phenyl]-N-(2,3-dimethylphenyl)methanimine
CID 126206108
(NZ)-N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine
CID 5408745
N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine
CID 126217896
2-[(2-fluorophenyl)methoxy]benzaldehyde
CID 2063523
N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]aniline
CID 169382467
2-[(E)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]guanidine
CID 97312635
1-[5-chloro-2-[(4-methylphenyl)methoxy]phenyl]-N-(2,3-dimethylphenyl)methanimine
CID 126208451
[2-[(2,3-dimethylphenyl)iminomethyl]phenyl] benzenesulfonate
CID 126218820
1-fluoro-2-[(2-methylphenyl)methoxy]benzene
CID 60627765
[(Z)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]urea
CID 71670043
1-[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]-N-(3-chloro-2-methylphenyl)methanimine
CID 126219723
1,1,2,2,3,3,3-heptafluoro-N-[(E)-[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]propan-1-amine
CID 126049446

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine?
The IUPAC name of N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine (CID 126221634) is N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine.
What is the SMILES notation for N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine?
The canonical SMILES for N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine is Cc1cccc(/N=C/c2ccccc2OCc2ccccc2F)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine?
The InChIKey is YQXQKZAXBCUYNM-ZVHZXABRSA-N. The full InChI is InChI=1S/C22H20FNO/c1-16-8-7-12-21(17(16)2)24-14-18-9-4-6-13-22(18)25-15-19-10-3-5-11-20(19)23/h3-14H,15H2,1-2H3/b24-14+.
What are the key properties of N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine?
N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine has a molecular weight of 333.41 g/mol, XLogP of 5.77, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine is sourced from PubChem (CID 126221634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).