2-chloro-4-(2-methoxyphenoxy)pyridine

C12H10ClNO2 — CID 63777956

IUPAC2-chloro-4-(2-methoxyphenoxy)pyridine
SMILESCOc1ccccc1Oc1ccnc(Cl)c1
InChIInChI=1S/C12H10ClNO2/c1-15-10-4-2-3-5-11(10)16-9-6-7-14-12(13)8-9/h2-8H,1H3
InChIKeyGXFNZHORHXUMEF-UHFFFAOYSA-N
MW235.67 g/mol
LogP3.54
Rot. Bonds3

About 2-chloro-4-(2-methoxyphenoxy)pyridine

2-chloro-4-(2-methoxyphenoxy)pyridine (PubChem CID 63777956) has the molecular formula C12H10ClNO2 and a molecular weight of 235.67 g/mol. Its IUPAC name is 2-chloro-4-(2-methoxyphenoxy)pyridine.

Molecular Properties

Compound Name2-chloro-4-(2-methoxyphenoxy)pyridine
PubChem CID63777956
Molecular FormulaC12H10ClNO2
Molecular Weight235.67 g/mol
Exact Mass235.04
IUPAC Name2-chloro-4-(2-methoxyphenoxy)pyridine
SMILESCOc1ccccc1Oc1ccnc(Cl)c1
InChIInChI=1S/C12H10ClNO2/c1-15-10-4-2-3-5-11(10)16-9-6-7-14-12(13)8-9/h2-8H,1H3
InChIKeyGXFNZHORHXUMEF-UHFFFAOYSA-N
XLogP3.54
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.67
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(2-methoxyphenoxy)pyridine?
The IUPAC name of 2-chloro-4-(2-methoxyphenoxy)pyridine (CID 63777956) is 2-chloro-4-(2-methoxyphenoxy)pyridine.
What is the SMILES notation for 2-chloro-4-(2-methoxyphenoxy)pyridine?
The canonical SMILES for 2-chloro-4-(2-methoxyphenoxy)pyridine is COc1ccccc1Oc1ccnc(Cl)c1.
What is the InChIKey of 2-chloro-4-(2-methoxyphenoxy)pyridine?
The InChIKey is GXFNZHORHXUMEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClNO2/c1-15-10-4-2-3-5-11(10)16-9-6-7-14-12(13)8-9/h2-8H,1H3.
What are the key properties of 2-chloro-4-(2-methoxyphenoxy)pyridine?
2-chloro-4-(2-methoxyphenoxy)pyridine has a molecular weight of 235.67 g/mol, XLogP of 3.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(2-methoxyphenoxy)pyridine is sourced from PubChem (CID 63777956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).