3,6-dichloro-2-(4-methoxyphenoxy)pyridine

C12H9Cl2NO2 — CID 70686995

IUPAC3,6-dichloro-2-(4-methoxyphenoxy)pyridine
SMILESCOc1ccc(Oc2nc(Cl)ccc2Cl)cc1
InChIInChI=1S/C12H9Cl2NO2/c1-16-8-2-4-9(5-3-8)17-12-10(13)6-7-11(14)15-12/h2-7H,1H3
InChIKeyDSCGLIXDOVGSAG-UHFFFAOYSA-N
MW270.12 g/mol
LogP4.19
Rot. Bonds3

About 3,6-dichloro-2-(4-methoxyphenoxy)pyridine

3,6-dichloro-2-(4-methoxyphenoxy)pyridine (PubChem CID 70686995) has the molecular formula C12H9Cl2NO2 and a molecular weight of 270.12 g/mol. Its IUPAC name is 3,6-dichloro-2-(4-methoxyphenoxy)pyridine.

Molecular Properties

Compound Name3,6-dichloro-2-(4-methoxyphenoxy)pyridine
PubChem CID70686995
Molecular FormulaC12H9Cl2NO2
Molecular Weight270.12 g/mol
Exact Mass269.00
IUPAC Name3,6-dichloro-2-(4-methoxyphenoxy)pyridine
SMILESCOc1ccc(Oc2nc(Cl)ccc2Cl)cc1
InChIInChI=1S/C12H9Cl2NO2/c1-16-8-2-4-9(5-3-8)17-12-10(13)6-7-11(14)15-12/h2-7H,1H3
InChIKeyDSCGLIXDOVGSAG-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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Related Compounds

Tcpobop
CID 5382
4-(3,5-Dichloro-pyridin-2-yloxy)-phenol
CID 620880
2-Chloro-6-ethoxypyridine
CID 98563
2-[3-(4-Chlorophenoxy)prop-1-yn-1-yl]-6-methylpyridine
CID 11345906
2-(3-(3-Chlorophenoxy)prop-1-ynyl)-6-methylpyridine
CID 44415963
2-tert-Butoxy-6-chloropyridine
CID 11984350
3,6-Dichloro-2-[4-(3,6-dichloropyridin-2-yl)oxyphenoxy]pyridine
CID 2427302
3,5-Dichloro-4-methoxy-2-phenoxy-6-(trichloromethyl)pyridine
CID 10894370
Methyl 2-[4-[(3,6-dichloro-2-pyridinyl)oxy]phenoxy]propanoate
CID 3548271
2-Ethoxyethyl 2-[4-[(3,6-dichloro-2-pyridinyl)oxy]phenoxy]propanoate
CID 4207350
3-Chloro-2,5,6-trifluoro-4-(4-methoxyphenoxy)pyridine
CID 872833
2-Chloro-6-(4-methoxyphenoxy)pyridine
CID 11459000

Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-2-(4-methoxyphenoxy)pyridine?
The IUPAC name of 3,6-dichloro-2-(4-methoxyphenoxy)pyridine (CID 70686995) is 3,6-dichloro-2-(4-methoxyphenoxy)pyridine.
What is the SMILES notation for 3,6-dichloro-2-(4-methoxyphenoxy)pyridine?
The canonical SMILES for 3,6-dichloro-2-(4-methoxyphenoxy)pyridine is COc1ccc(Oc2nc(Cl)ccc2Cl)cc1.
What is the InChIKey of 3,6-dichloro-2-(4-methoxyphenoxy)pyridine?
The InChIKey is DSCGLIXDOVGSAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2NO2/c1-16-8-2-4-9(5-3-8)17-12-10(13)6-7-11(14)15-12/h2-7H,1H3.
What are the key properties of 3,6-dichloro-2-(4-methoxyphenoxy)pyridine?
3,6-dichloro-2-(4-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 3,6-dichloro-2-(4-methoxyphenoxy)pyridine is sourced from PubChem (CID 70686995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).