2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine

C10H14ClNO3 — CID 104561399

IUPAC2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine
SMILESCOCCOCCOc1cccc(Cl)n1
InChIInChI=1S/C10H14ClNO3/c1-13-5-6-14-7-8-15-10-4-2-3-9(11)12-10/h2-4H,5-8H2,1H3
InChIKeyFZOIZJPSOCVHAO-UHFFFAOYSA-N
MW231.68 g/mol
LogP1.78
Rot. Bonds7

About 2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine

2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine (PubChem CID 104561399) has the molecular formula C10H14ClNO3 and a molecular weight of 231.68 g/mol. Its IUPAC name is 2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine.

Molecular Properties

Compound Name2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine
PubChem CID104561399
Molecular FormulaC10H14ClNO3
Molecular Weight231.68 g/mol
Exact Mass231.07
IUPAC Name2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine
SMILESCOCCOCCOc1cccc(Cl)n1
InChIInChI=1S/C10H14ClNO3/c1-13-5-6-14-7-8-15-10-4-2-3-9(11)12-10/h2-4H,5-8H2,1H3
InChIKeyFZOIZJPSOCVHAO-UHFFFAOYSA-N
XLogP1.78
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.68
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine?
The IUPAC name of 2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine (CID 104561399) is 2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine.
What is the SMILES notation for 2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine?
The canonical SMILES for 2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine is COCCOCCOc1cccc(Cl)n1.
What is the InChIKey of 2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine?
The InChIKey is FZOIZJPSOCVHAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClNO3/c1-13-5-6-14-7-8-15-10-4-2-3-9(11)12-10/h2-4H,5-8H2,1H3.
What are the key properties of 2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine?
2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine has a molecular weight of 231.68 g/mol, XLogP of 1.78, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine is sourced from PubChem (CID 104561399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).