2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine

C20H20N2O4 — CID 100972604

IUPAC2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine
SMILESc1ccc(OCCOc2ccccc2OCCOc2ccccn2)nc1
InChIInChI=1S/C20H20N2O4/c1-2-8-18(24-14-16-26-20-10-4-6-12-22-20)17(7-1)23-13-15-25-19-9-3-5-11-21-19/h1-12H,13-16H2
InChIKeyROJMFWGZJOEHRQ-UHFFFAOYSA-N
MW352.39 g/mol
LogP3.39
Rot. Bonds10

About 2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine

2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine (PubChem CID 100972604) has the molecular formula C20H20N2O4 and a molecular weight of 352.39 g/mol. Its IUPAC name is 2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine.

Molecular Properties

Compound Name2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine
PubChem CID100972604
Molecular FormulaC20H20N2O4
Molecular Weight352.39 g/mol
Exact Mass352.14
IUPAC Name2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine
SMILESc1ccc(OCCOc2ccccc2OCCOc2ccccn2)nc1
InChIInChI=1S/C20H20N2O4/c1-2-8-18(24-14-16-26-20-10-4-6-12-22-20)17(7-1)23-13-15-25-19-9-3-5-11-21-19/h1-12H,13-16H2
InChIKeyROJMFWGZJOEHRQ-UHFFFAOYSA-N
XLogP3.39
TPSA62.70 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

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2-(4-(2-(Pyrrolidin-1-yl)ethoxy)phenoxy)pyridine
CID 49805049
2-(Dodecyloxy)pyridine
CID 96440
4-[[4-[(4-Fluorophenoxy)methyl]piperidin-1-yl]methyl]pyridine;hydrate
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1-[4-(2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine
CID 44452747
N,N-dimethyl-1-[6-methyl-4-(2-phenoxyphenoxy)-3-pyridinyl]methanamine
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CID 44453119

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine?
The IUPAC name of 2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine (CID 100972604) is 2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine.
What is the SMILES notation for 2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine?
The canonical SMILES for 2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine is c1ccc(OCCOc2ccccc2OCCOc2ccccn2)nc1.
What is the InChIKey of 2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine?
The InChIKey is ROJMFWGZJOEHRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4/c1-2-8-18(24-14-16-26-20-10-4-6-12-22-20)17(7-1)23-13-15-25-19-9-3-5-11-21-19/h1-12H,13-16H2.
What are the key properties of 2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine?
2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine has a molecular weight of 352.39 g/mol, XLogP of 3.39, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-pyridin-2-yloxyethoxy)phenoxy]ethoxy]pyridine is sourced from PubChem (CID 100972604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).