1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine

C14H12FNO — CID 966937

IUPAC1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine
SMILESCOc1ccc(/N=C/c2ccc(F)cc2)cc1
InChIInChI=1S/C14H12FNO/c1-17-14-8-6-13(7-9-14)16-10-11-2-4-12(15)5-3-11/h2-10H,1H3/b16-10+
InChIKeyRAXZKIAJTMJMLN-MHWRWJLKSA-N
MW229.25 g/mol
LogP3.58
Rot. Bonds3

About 1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine

1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine (PubChem CID 966937) has the molecular formula C14H12FNO and a molecular weight of 229.25 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine
PubChem CID966937
Molecular FormulaC14H12FNO
Molecular Weight229.25 g/mol
Exact Mass229.09
IUPAC Name1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine
SMILESCOc1ccc(/N=C/c2ccc(F)cc2)cc1
InChIInChI=1S/C14H12FNO/c1-17-14-8-6-13(7-9-14)16-10-11-2-4-12(15)5-3-11/h2-10H,1H3/b16-10+
InChIKeyRAXZKIAJTMJMLN-MHWRWJLKSA-N
XLogP3.58
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.25
LogP ≤ 53.58
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-(4-methoxyphenyl)methanimine?
The IUPAC name of 1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine (CID 966937) is 1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine.
What is the SMILES notation for 1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine?
The canonical SMILES for 1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine is COc1ccc(/N=C/c2ccc(F)cc2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine?
The InChIKey is RAXZKIAJTMJMLN-MHWRWJLKSA-N. The full InChI is InChI=1S/C14H12FNO/c1-17-14-8-6-13(7-9-14)16-10-11-2-4-12(15)5-3-11/h2-10H,1H3/b16-10+.
What are the key properties of 1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine?
1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine has a molecular weight of 229.25 g/mol, XLogP of 3.58, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-(4-methoxyphenyl)methanimine is sourced from PubChem (CID 966937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).