4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile

C14H12N2O3 — CID 1484342

IUPAC4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile
SMILESCOc1ccc(Oc2nccc(OC)c2C#N)cc1
InChIInChI=1S/C14H12N2O3/c1-17-10-3-5-11(6-4-10)19-14-12(9-15)13(18-2)7-8-16-14/h3-8H,1-2H3
InChIKeyNIPLMEDDKHWEJY-UHFFFAOYSA-N
MW256.26 g/mol
LogP2.76
Rot. Bonds4

About 4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile

4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile (PubChem CID 1484342) has the molecular formula C14H12N2O3 and a molecular weight of 256.26 g/mol. Its IUPAC name is 4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile.

Molecular Properties

Compound Name4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile
PubChem CID1484342
Molecular FormulaC14H12N2O3
Molecular Weight256.26 g/mol
Exact Mass256.08
IUPAC Name4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile
SMILESCOc1ccc(Oc2nccc(OC)c2C#N)cc1
InChIInChI=1S/C14H12N2O3/c1-17-10-3-5-11(6-4-10)19-14-12(9-15)13(18-2)7-8-16-14/h3-8H,1-2H3
InChIKeyNIPLMEDDKHWEJY-UHFFFAOYSA-N
XLogP2.76
TPSA64.37 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile?
The IUPAC name of 4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile (CID 1484342) is 4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile.
What is the SMILES notation for 4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile?
The canonical SMILES for 4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile is COc1ccc(Oc2nccc(OC)c2C#N)cc1.
What is the InChIKey of 4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile?
The InChIKey is NIPLMEDDKHWEJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O3/c1-17-10-3-5-11(6-4-10)19-14-12(9-15)13(18-2)7-8-16-14/h3-8H,1-2H3.
What are the key properties of 4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile?
4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile has a molecular weight of 256.26 g/mol, XLogP of 2.76, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(4-methoxyphenoxy)pyridine-3-carbonitrile is sourced from PubChem (CID 1484342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).