(E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine

C20H15FN2 — CID 6902465

IUPAC(E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine
SMILESFc1cccc(/C=N/N=C(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C20H15FN2/c21-19-13-7-8-16(14-19)15-22-23-20(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-15H/b22-15+
InChIKeyCMFZDDABQSSPAD-PXLXIMEGSA-N
MW302.35 g/mol
LogP4.70
Rot. Bonds4

About (E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine

(E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine (PubChem CID 6902465) has the molecular formula C20H15FN2 and a molecular weight of 302.35 g/mol. Its IUPAC name is (E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine.

Molecular Properties

Compound Name(E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine
PubChem CID6902465
Molecular FormulaC20H15FN2
Molecular Weight302.35 g/mol
Exact Mass302.12
IUPAC Name(E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine
SMILESFc1cccc(/C=N/N=C(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C20H15FN2/c21-19-13-7-8-16(14-19)15-22-23-20(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-15H/b22-15+
InChIKeyCMFZDDABQSSPAD-PXLXIMEGSA-N
XLogP4.70
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.35
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine?
The IUPAC name of (E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine (CID 6902465) is (E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine.
What is the SMILES notation for (E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine?
The canonical SMILES for (E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine is Fc1cccc(/C=N/N=C(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of (E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine?
The InChIKey is CMFZDDABQSSPAD-PXLXIMEGSA-N. The full InChI is InChI=1S/C20H15FN2/c21-19-13-7-8-16(14-19)15-22-23-20(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-15H/b22-15+.
What are the key properties of (E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine?
(E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine has a molecular weight of 302.35 g/mol, XLogP of 4.70, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[(E)-(3-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine is sourced from PubChem (CID 6902465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).