N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine

C24H16F3NO — CID 161055138

IUPACN-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine
SMILESFC(F)(F)c1ccccc1-c1ccc(/C=N/c2ccccc2-c2ccccc2)o1
InChIInChI=1S/C24H16F3NO/c25-24(26,27)21-12-6-4-11-20(21)23-15-14-18(29-23)16-28-22-13-7-5-10-19(22)17-8-2-1-3-9-17/h1-16H/b28-16+
InChIKeyUCQMPOWBTJUCRY-LQKURTRISA-N
MW391.39 g/mol
LogP7.38
Rot. Bonds4

About N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine

N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine (PubChem CID 161055138) has the molecular formula C24H16F3NO and a molecular weight of 391.39 g/mol. Its IUPAC name is N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine.

Molecular Properties

Compound NameN-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine
PubChem CID161055138
Molecular FormulaC24H16F3NO
Molecular Weight391.39 g/mol
Exact Mass391.12
IUPAC NameN-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine
SMILESFC(F)(F)c1ccccc1-c1ccc(/C=N/c2ccccc2-c2ccccc2)o1
InChIInChI=1S/C24H16F3NO/c25-24(26,27)21-12-6-4-11-20(21)23-15-14-18(29-23)16-28-22-13-7-5-10-19(22)17-8-2-1-3-9-17/h1-16H/b28-16+
InChIKeyUCQMPOWBTJUCRY-LQKURTRISA-N
XLogP7.38
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.39
LogP ≤ 57.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine?
The IUPAC name of N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine (CID 161055138) is N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine.
What is the SMILES notation for N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine?
The canonical SMILES for N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine is FC(F)(F)c1ccccc1-c1ccc(/C=N/c2ccccc2-c2ccccc2)o1.
What is the InChIKey of N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine?
The InChIKey is UCQMPOWBTJUCRY-LQKURTRISA-N. The full InChI is InChI=1S/C24H16F3NO/c25-24(26,27)21-12-6-4-11-20(21)23-15-14-18(29-23)16-28-22-13-7-5-10-19(22)17-8-2-1-3-9-17/h1-16H/b28-16+.
What are the key properties of N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine?
N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine has a molecular weight of 391.39 g/mol, XLogP of 7.38, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylphenyl)-1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methanimine is sourced from PubChem (CID 161055138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).