1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine

C22H17F2N — CID 139186375

IUPAC1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine
SMILESCc1ccc(/C=C\N=C(c2ccc(F)cc2)c2ccc(F)cc2)cc1
InChIInChI=1S/C22H17F2N/c1-16-2-4-17(5-3-16)14-15-25-22(18-6-10-20(23)11-7-18)19-8-12-21(24)13-9-19/h2-15H,1H3/b15-14-
InChIKeyWIIMLYIBPDUEIE-PFONDFGASA-N
MW333.38 g/mol
LogP5.78
Rot. Bonds4

About 1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine

1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine (PubChem CID 139186375) has the molecular formula C22H17F2N and a molecular weight of 333.38 g/mol. Its IUPAC name is 1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine.

Molecular Properties

Compound Name1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine
PubChem CID139186375
Molecular FormulaC22H17F2N
Molecular Weight333.38 g/mol
Exact Mass333.13
IUPAC Name1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine
SMILESCc1ccc(/C=C\N=C(c2ccc(F)cc2)c2ccc(F)cc2)cc1
InChIInChI=1S/C22H17F2N/c1-16-2-4-17(5-3-16)14-15-25-22(18-6-10-20(23)11-7-18)19-8-12-21(24)13-9-19/h2-15H,1H3/b15-14-
InChIKeyWIIMLYIBPDUEIE-PFONDFGASA-N
XLogP5.78
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.38
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-(4-Methylphenyl)-2-phenyl-6,7-dihydro-5h-1,4-diazepine
CID 44563825
2,3-bis(4-methylphenyl)-6,7-dihydro-5H-1,4-diazepine
CID 44563890
1,1-diphenyl-N-(1,1,1-trifluoropent-4-en-2-yl)methanimine
CID 10935569
2,3-Bis(4-fluorophenyl)-5,6-dihydropyrazine
CID 12342949
N-[(4-fluorophenyl)methyl]-1,1-diphenylmethanimine
CID 159448586
Ethanamine, N-(diphenylmethylene)-2,2,2-trifluoro-
CID 10869109
3-Cyano-4-(2-fluorophenyl)-1,1-diphenyl-2-aza-1,3-butadiene
CID 10871095
N-[1-(4-fluorophenyl)-3-methylbut-3-enyl]-1,1-diphenylmethanimine
CID 11858934
1,1-diphenyl-N-[(1R)-1-[4-(trifluoromethyl)phenyl]but-3-enyl]methanimine
CID 102030759
N-[(1R)-1-(3,5-difluorophenyl)but-3-enyl]-1,1-diphenylmethanimine
CID 102030760
1,1-diphenyl-N-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]methanimine
CID 102082770
(2-diethylazaniumylidene-2-phenylethyl)-[(1E)-3-methylbuta-1,3-dienyl]-bis(2,3,4,5,6-pentafluorophenyl)boranuide
CID 122208209

Frequently Asked Questions

What is the IUPAC name of 1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine?
The IUPAC name of 1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine (CID 139186375) is 1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine.
What is the SMILES notation for 1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine?
The canonical SMILES for 1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine is Cc1ccc(/C=C\N=C(c2ccc(F)cc2)c2ccc(F)cc2)cc1.
What is the InChIKey of 1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine?
The InChIKey is WIIMLYIBPDUEIE-PFONDFGASA-N. The full InChI is InChI=1S/C22H17F2N/c1-16-2-4-17(5-3-16)14-15-25-22(18-6-10-20(23)11-7-18)19-8-12-21(24)13-9-19/h2-15H,1H3/b15-14-.
What are the key properties of 1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine?
1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine has a molecular weight of 333.38 g/mol, XLogP of 5.78, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(4-fluorophenyl)-N-[(Z)-2-(4-methylphenyl)ethenyl]methanimine is sourced from PubChem (CID 139186375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).