1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine

C20H16FNO — CID 821942

IUPAC1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine
SMILESCOc1ccc(-c2ccc(/N=C/c3ccc(F)cc3)cc2)cc1
InChIInChI=1S/C20H16FNO/c1-23-20-12-6-17(7-13-20)16-4-10-19(11-5-16)22-14-15-2-8-18(21)9-3-15/h2-14H,1H3/b22-14+
InChIKeyXWODIHNNQODVJE-HYARGMPZSA-N
MW305.35 g/mol
LogP5.25
Rot. Bonds4

About 1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine

1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine (PubChem CID 821942) has the molecular formula C20H16FNO and a molecular weight of 305.35 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine
PubChem CID821942
Molecular FormulaC20H16FNO
Molecular Weight305.35 g/mol
Exact Mass305.12
IUPAC Name1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine
SMILESCOc1ccc(-c2ccc(/N=C/c3ccc(F)cc3)cc2)cc1
InChIInChI=1S/C20H16FNO/c1-23-20-12-6-17(7-13-20)16-4-10-19(11-5-16)22-14-15-2-8-18(21)9-3-15/h2-14H,1H3/b22-14+
InChIKeyXWODIHNNQODVJE-HYARGMPZSA-N
XLogP5.25
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500305.35
LogP ≤ 55.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

acetylene;N-(4-fluorophenyl)-1-(4-methoxyphenyl)methanimine;formaldehyde
CID 145351672
4-[(4-methoxyphenyl)methylideneamino]-N,N-dimethylaniline
CID 3748752
1-(4-fluorophenyl)-N-(4-phenoxyphenyl)methanimine
CID 932026
N-(3-fluoro-4-methylphenyl)-1-(4-methoxyphenyl)methanimine
CID 693625
1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine
CID 71354195
1-(4-methoxyphenyl)-N-[3-[(4-methoxyphenyl)methylideneamino]phenyl]methanimine
CID 18527961
1-(4-methoxyphenyl)-N-(2,3,4,5,6-pentafluorophenyl)methanimine
CID 12643120
1-(4-fluorophenyl)-N-[4-(4-nitrophenyl)phenyl]methanimine
CID 21177104
(NE)-N-[1-[4-[(4-methoxyphenyl)methylideneamino]phenyl]ethylidene]hydroxylamine
CID 134612915
1-(4-fluorophenyl)-N-(4-iodophenyl)methanimine
CID 554998
4-[(4-fluorophenyl)methylideneamino]benzenethiol
CID 15543881
[3-[(4-fluorophenyl)methylideneamino]-5-methoxyphenyl]methanol
CID 86729004

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine?
The IUPAC name of 1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine (CID 821942) is 1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine.
What is the SMILES notation for 1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine?
The canonical SMILES for 1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine is COc1ccc(-c2ccc(/N=C/c3ccc(F)cc3)cc2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine?
The InChIKey is XWODIHNNQODVJE-HYARGMPZSA-N. The full InChI is InChI=1S/C20H16FNO/c1-23-20-12-6-17(7-13-20)16-4-10-19(11-5-16)22-14-15-2-8-18(21)9-3-15/h2-14H,1H3/b22-14+.
What are the key properties of 1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine?
1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine has a molecular weight of 305.35 g/mol, XLogP of 5.25, 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-(4-methoxyphenyl)phenyl]methanimine is sourced from PubChem (CID 821942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).