4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine

C18H17N3O2 — CID 14879099

IUPAC4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine
SMILESCOCCOc1cc(-c2ccccn2)nc(-c2ccccn2)c1
InChIInChI=1S/C18H17N3O2/c1-22-10-11-23-14-12-17(15-6-2-4-8-19-15)21-18(13-14)16-7-3-5-9-20-16/h2-9,12-13H,10-11H2,1H3
InChIKeyKYNXGTUDZQGIOA-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.23
Rot. Bonds6

About 4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine

4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine (PubChem CID 14879099) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is 4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine.

Molecular Properties

Compound Name4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine
PubChem CID14879099
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC Name4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine
SMILESCOCCOc1cc(-c2ccccn2)nc(-c2ccccn2)c1
InChIInChI=1S/C18H17N3O2/c1-22-10-11-23-14-12-17(15-6-2-4-8-19-15)21-18(13-14)16-7-3-5-9-20-16/h2-9,12-13H,10-11H2,1H3
InChIKeyKYNXGTUDZQGIOA-UHFFFAOYSA-N
XLogP3.23
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine?
The IUPAC name of 4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine (CID 14879099) is 4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine.
What is the SMILES notation for 4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine?
The canonical SMILES for 4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine is COCCOc1cc(-c2ccccn2)nc(-c2ccccn2)c1.
What is the InChIKey of 4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine?
The InChIKey is KYNXGTUDZQGIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-22-10-11-23-14-12-17(15-6-2-4-8-19-15)21-18(13-14)16-7-3-5-9-20-16/h2-9,12-13H,10-11H2,1H3.
What are the key properties of 4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine?
4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine has a molecular weight of 307.35 g/mol, XLogP of 3.23, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethoxy)-2,6-dipyridin-2-ylpyridine is sourced from PubChem (CID 14879099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).