2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile

C14H10N4O2 — CID 12736655

IUPAC2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile
SMILESCOc1ccc(Oc2nc(N)c(C#N)cc2C#N)cc1
InChIInChI=1S/C14H10N4O2/c1-19-11-2-4-12(5-3-11)20-14-10(8-16)6-9(7-15)13(17)18-14/h2-6H,1H3,(H2,17,18)
InChIKeyIKUJAUBTHDAKQR-UHFFFAOYSA-N
MW266.26 g/mol
LogP2.21
Rot. Bonds3

About 2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile

2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile (PubChem CID 12736655) has the molecular formula C14H10N4O2 and a molecular weight of 266.26 g/mol. Its IUPAC name is 2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile.

Molecular Properties

Compound Name2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile
PubChem CID12736655
Molecular FormulaC14H10N4O2
Molecular Weight266.26 g/mol
Exact Mass266.08
IUPAC Name2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile
SMILESCOc1ccc(Oc2nc(N)c(C#N)cc2C#N)cc1
InChIInChI=1S/C14H10N4O2/c1-19-11-2-4-12(5-3-11)20-14-10(8-16)6-9(7-15)13(17)18-14/h2-6H,1H3,(H2,17,18)
InChIKeyIKUJAUBTHDAKQR-UHFFFAOYSA-N
XLogP2.21
TPSA104.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile?
The IUPAC name of 2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile (CID 12736655) is 2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile.
What is the SMILES notation for 2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile?
The canonical SMILES for 2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile is COc1ccc(Oc2nc(N)c(C#N)cc2C#N)cc1.
What is the InChIKey of 2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile?
The InChIKey is IKUJAUBTHDAKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4O2/c1-19-11-2-4-12(5-3-11)20-14-10(8-16)6-9(7-15)13(17)18-14/h2-6H,1H3,(H2,17,18).
What are the key properties of 2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile?
2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile has a molecular weight of 266.26 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(4-methoxyphenoxy)pyridine-3,5-dicarbonitrile is sourced from PubChem (CID 12736655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).