2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine

C12H9Cl2NO2 — CID 71512689

IUPAC2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine
SMILESCOc1cc(Cl)cc(Oc2ccnc(Cl)c2)c1
InChIInChI=1S/C12H9Cl2NO2/c1-16-10-4-8(13)5-11(6-10)17-9-2-3-15-12(14)7-9/h2-7H,1H3
InChIKeyNDLDMCYLEDCXJD-UHFFFAOYSA-N
MW270.12 g/mol
LogP4.19
Rot. Bonds3

About 2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine

2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine (PubChem CID 71512689) has the molecular formula C12H9Cl2NO2 and a molecular weight of 270.12 g/mol. Its IUPAC name is 2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine.

Molecular Properties

Compound Name2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine
PubChem CID71512689
Molecular FormulaC12H9Cl2NO2
Molecular Weight270.12 g/mol
Exact Mass269.00
IUPAC Name2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine
SMILESCOc1cc(Cl)cc(Oc2ccnc(Cl)c2)c1
InChIInChI=1S/C12H9Cl2NO2/c1-16-10-4-8(13)5-11(6-10)17-9-2-3-15-12(14)7-9/h2-7H,1H3
InChIKeyNDLDMCYLEDCXJD-UHFFFAOYSA-N
XLogP4.19
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.12
LogP ≤ 54.19
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-(3-chloro-5-methoxyphenoxy)pyridine?
The IUPAC name of 2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine (CID 71512689) is 2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine.
What is the SMILES notation for 2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine?
The canonical SMILES for 2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine is COc1cc(Cl)cc(Oc2ccnc(Cl)c2)c1.
What is the InChIKey of 2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine?
The InChIKey is NDLDMCYLEDCXJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2NO2/c1-16-10-4-8(13)5-11(6-10)17-9-2-3-15-12(14)7-9/h2-7H,1H3.
What are the key properties of 2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine?
2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine has a molecular weight of 270.12 g/mol, XLogP of 4.19, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(3-chloro-5-methoxyphenoxy)pyridine is sourced from PubChem (CID 71512689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).