1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine

C14H11F2NO — CID 76856167

IUPAC1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine
SMILESFc1ccc(C=NOCc2ccc(F)cc2)cc1
InChIInChI=1S/C14H11F2NO/c15-13-5-1-11(2-6-13)9-17-18-10-12-3-7-14(16)8-4-12/h1-9H,10H2
InChIKeyOLNGQYWOCAMUBE-UHFFFAOYSA-N
MW247.24 g/mol
LogP3.52
Rot. Bonds4

About 1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine

1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine (PubChem CID 76856167) has the molecular formula C14H11F2NO and a molecular weight of 247.24 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine
PubChem CID76856167
Molecular FormulaC14H11F2NO
Molecular Weight247.24 g/mol
Exact Mass247.08
IUPAC Name1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine
SMILESFc1ccc(C=NOCc2ccc(F)cc2)cc1
InChIInChI=1S/C14H11F2NO/c15-13-5-1-11(2-6-13)9-17-18-10-12-3-7-14(16)8-4-12/h1-9H,10H2
InChIKeyOLNGQYWOCAMUBE-UHFFFAOYSA-N
XLogP3.52
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.24
LogP ≤ 53.52
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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Related Compounds

4-[[(4-fluorophenyl)methylideneamino]oxymethyl]benzonitrile
CID 75265021
N-[(3-chlorophenyl)methoxy]-1-(4-fluorophenyl)methanimine
CID 76856157
N-[[4-[(benzylideneamino)oxymethyl]phenyl]methoxy]-1-phenylmethanimine
CID 2457580
1-(4-ethoxy-3-methoxyphenyl)-N-[(4-fluorophenyl)methoxy]methanimine
CID 76856065
N-[(2,6-dichlorophenyl)methoxy]-1-(4-fluorophenyl)methanimine
CID 76856168
4-[(E)-[4-(trifluoromethyl)phenyl]methoxyiminomethyl]phenol
CID 135580355
N-[(4-bromophenyl)methoxy]-1-(4-chlorophenyl)methanimine
CID 73380524
N-[(4-bromo-2-fluorophenyl)methoxy]-1-(4-fluorophenyl)methanimine
CID 76856145
3-[(E)-(4-fluorophenyl)methylideneamino]oxypropan-1-amine
CID 58685118
(1E)-1-[(4-fluorophenyl)methoxyimino]propan-2-amine
CID 58684892
(E)-N-[(4-chlorophenyl)methoxy]-1-phenylmethanimine
CID 117060747
(E)-1-(4-methoxyphenyl)-N-phenylmethoxymethanimine
CID 11499688

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine?
The IUPAC name of 1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine (CID 76856167) is 1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine.
What is the SMILES notation for 1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine?
The canonical SMILES for 1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine is Fc1ccc(C=NOCc2ccc(F)cc2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine?
The InChIKey is OLNGQYWOCAMUBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2NO/c15-13-5-1-11(2-6-13)9-17-18-10-12-3-7-14(16)8-4-12/h1-9H,10H2.
What are the key properties of 1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine?
1-(4-fluorophenyl)-N-[(4-fluorophenyl)methoxy]methanimine has a molecular weight of 247.24 g/mol, XLogP of 3.52, 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-[(4-fluorophenyl)methoxy]methanimine is sourced from PubChem (CID 76856167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).