1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine

C24H16F2N2 — CID 565462

IUPAC1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine
SMILESFc1ccc(/C=N/c2cccc3c(/N=C/c4ccc(F)cc4)cccc23)cc1
InChIInChI=1S/C24H16F2N2/c25-19-11-7-17(8-12-19)15-27-23-5-1-3-21-22(23)4-2-6-24(21)28-16-18-9-13-20(26)14-10-18/h1-16H/b27-15+,28-16+
InChIKeyRGGQDKYQWSWGKS-DPCVLPDWSA-N
MW370.40 g/mol
LogP6.62
Rot. Bonds4

About 1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine

1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine (PubChem CID 565462) has the molecular formula C24H16F2N2 and a molecular weight of 370.40 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine
PubChem CID565462
Molecular FormulaC24H16F2N2
Molecular Weight370.40 g/mol
Exact Mass370.13
IUPAC Name1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine
SMILESFc1ccc(/C=N/c2cccc3c(/N=C/c4ccc(F)cc4)cccc23)cc1
InChIInChI=1S/C24H16F2N2/c25-19-11-7-17(8-12-19)15-27-23-5-1-3-21-22(23)4-2-6-24(21)28-16-18-9-13-20(26)14-10-18/h1-16H/b27-15+,28-16+
InChIKeyRGGQDKYQWSWGKS-DPCVLPDWSA-N
XLogP6.62
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.40
LogP ≤ 56.62
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 1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine?
The IUPAC name of 1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine (CID 565462) is 1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine.
What is the SMILES notation for 1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine?
The canonical SMILES for 1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine is Fc1ccc(/C=N/c2cccc3c(/N=C/c4ccc(F)cc4)cccc23)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine?
The InChIKey is RGGQDKYQWSWGKS-DPCVLPDWSA-N. The full InChI is InChI=1S/C24H16F2N2/c25-19-11-7-17(8-12-19)15-27-23-5-1-3-21-22(23)4-2-6-24(21)28-16-18-9-13-20(26)14-10-18/h1-16H/b27-15+,28-16+.
What are the key properties of 1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine?
1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine has a molecular weight of 370.40 g/mol, XLogP of 6.62, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-[5-[(4-fluorophenyl)methylideneamino]naphthalen-1-yl]methanimine is sourced from PubChem (CID 565462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).