2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine

C19H19N3O2 — CID 59779226

IUPAC2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine
SMILESCOCc1ccc(-c2cccc(-c3ccc(COC)cn3)n2)nc1
InChIInChI=1S/C19H19N3O2/c1-23-12-14-6-8-16(20-10-14)18-4-3-5-19(22-18)17-9-7-15(11-21-17)13-24-2/h3-11H,12-13H2,1-2H3
InChIKeyCXEWDUJRKUCKCV-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.50
Rot. Bonds6

About 2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine

2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine (PubChem CID 59779226) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine.

Molecular Properties

Compound Name2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine
PubChem CID59779226
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine
SMILESCOCc1ccc(-c2cccc(-c3ccc(COC)cn3)n2)nc1
InChIInChI=1S/C19H19N3O2/c1-23-12-14-6-8-16(20-10-14)18-4-3-5-19(22-18)17-9-7-15(11-21-17)13-24-2/h3-11H,12-13H2,1-2H3
InChIKeyCXEWDUJRKUCKCV-UHFFFAOYSA-N
XLogP3.50
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine?
The IUPAC name of 2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine (CID 59779226) is 2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine.
What is the SMILES notation for 2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine?
The canonical SMILES for 2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine is COCc1ccc(-c2cccc(-c3ccc(COC)cn3)n2)nc1.
What is the InChIKey of 2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine?
The InChIKey is CXEWDUJRKUCKCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-23-12-14-6-8-16(20-10-14)18-4-3-5-19(22-18)17-9-7-15(11-21-17)13-24-2/h3-11H,12-13H2,1-2H3.
What are the key properties of 2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine?
2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine has a molecular weight of 321.38 g/mol, XLogP of 3.50, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis[5-(methoxymethyl)-2-pyridinyl]pyridine is sourced from PubChem (CID 59779226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).