1-(4-fluorophenyl)-N-phenylmethoxymethanimine

C14H12FNO — CID 75981073

IUPAC1-(4-fluorophenyl)-N-phenylmethoxymethanimine
SMILESFc1ccc(C=NOCc2ccccc2)cc1
InChIInChI=1S/C14H12FNO/c15-14-8-6-12(7-9-14)10-16-17-11-13-4-2-1-3-5-13/h1-10H,11H2
InChIKeyYSOZSHLYGVWWRB-UHFFFAOYSA-N
MW229.25 g/mol
LogP3.38
Rot. Bonds4

About 1-(4-fluorophenyl)-N-phenylmethoxymethanimine

1-(4-fluorophenyl)-N-phenylmethoxymethanimine (PubChem CID 75981073) has the molecular formula C14H12FNO and a molecular weight of 229.25 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-phenylmethoxymethanimine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-phenylmethoxymethanimine
PubChem CID75981073
Molecular FormulaC14H12FNO
Molecular Weight229.25 g/mol
Exact Mass229.09
IUPAC Name1-(4-fluorophenyl)-N-phenylmethoxymethanimine
SMILESFc1ccc(C=NOCc2ccccc2)cc1
InChIInChI=1S/C14H12FNO/c15-14-8-6-12(7-9-14)10-16-17-11-13-4-2-1-3-5-13/h1-10H,11H2
InChIKeyYSOZSHLYGVWWRB-UHFFFAOYSA-N
XLogP3.38
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.25
LogP ≤ 53.38
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 1-(4-fluorophenyl)-N-phenylmethoxymethanimine?
The IUPAC name of 1-(4-fluorophenyl)-N-phenylmethoxymethanimine (CID 75981073) is 1-(4-fluorophenyl)-N-phenylmethoxymethanimine.
What is the SMILES notation for 1-(4-fluorophenyl)-N-phenylmethoxymethanimine?
The canonical SMILES for 1-(4-fluorophenyl)-N-phenylmethoxymethanimine is Fc1ccc(C=NOCc2ccccc2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-N-phenylmethoxymethanimine?
The InChIKey is YSOZSHLYGVWWRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO/c15-14-8-6-12(7-9-14)10-16-17-11-13-4-2-1-3-5-13/h1-10H,11H2.
What are the key properties of 1-(4-fluorophenyl)-N-phenylmethoxymethanimine?
1-(4-fluorophenyl)-N-phenylmethoxymethanimine has a molecular weight of 229.25 g/mol, XLogP of 3.38, 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-phenylmethoxymethanimine is sourced from PubChem (CID 75981073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).