4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile

C20H15FN2O2 — CID 57341000

IUPAC4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile
SMILESCOc1ccc(-c2cc(-c3ccc(F)cc3)c(C#N)c(OC)n2)cc1
InChIInChI=1S/C20H15FN2O2/c1-24-16-9-5-14(6-10-16)19-11-17(13-3-7-15(21)8-4-13)18(12-22)20(23-19)25-2/h3-11H,1-2H3
InChIKeyYLBKLNXCPDMGOO-UHFFFAOYSA-N
MW334.35 g/mol
LogP4.44
Rot. Bonds4

About 4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile

4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile (PubChem CID 57341000) has the molecular formula C20H15FN2O2 and a molecular weight of 334.35 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile
PubChem CID57341000
Molecular FormulaC20H15FN2O2
Molecular Weight334.35 g/mol
Exact Mass334.11
IUPAC Name4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile
SMILESCOc1ccc(-c2cc(-c3ccc(F)cc3)c(C#N)c(OC)n2)cc1
InChIInChI=1S/C20H15FN2O2/c1-24-16-9-5-14(6-10-16)19-11-17(13-3-7-15(21)8-4-13)18(12-22)20(23-19)25-2/h3-11H,1-2H3
InChIKeyYLBKLNXCPDMGOO-UHFFFAOYSA-N
XLogP4.44
TPSA55.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.35
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile?
The IUPAC name of 4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile (CID 57341000) is 4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile.
What is the SMILES notation for 4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile?
The canonical SMILES for 4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile is COc1ccc(-c2cc(-c3ccc(F)cc3)c(C#N)c(OC)n2)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile?
The InChIKey is YLBKLNXCPDMGOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN2O2/c1-24-16-9-5-14(6-10-16)19-11-17(13-3-7-15(21)8-4-13)18(12-22)20(23-19)25-2/h3-11H,1-2H3.
What are the key properties of 4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile?
4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile has a molecular weight of 334.35 g/mol, XLogP of 4.44, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-2-methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile is sourced from PubChem (CID 57341000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).