3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine

C13H13ClN2O — CID 103174660

IUPAC3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine
SMILESCCc1nc(C)ccc1Oc1cccc(Cl)n1
InChIInChI=1S/C13H13ClN2O/c1-3-10-11(8-7-9(2)15-10)17-13-6-4-5-12(14)16-13/h4-8H,3H2,1-2H3
InChIKeyPGIXSIDBSQNVHA-UHFFFAOYSA-N
MW248.71 g/mol
LogP3.79
Rot. Bonds3

About 3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine

3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine (PubChem CID 103174660) has the molecular formula C13H13ClN2O and a molecular weight of 248.71 g/mol. Its IUPAC name is 3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine.

Molecular Properties

Compound Name3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine
PubChem CID103174660
Molecular FormulaC13H13ClN2O
Molecular Weight248.71 g/mol
Exact Mass248.07
IUPAC Name3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine
SMILESCCc1nc(C)ccc1Oc1cccc(Cl)n1
InChIInChI=1S/C13H13ClN2O/c1-3-10-11(8-7-9(2)15-10)17-13-6-4-5-12(14)16-13/h4-8H,3H2,1-2H3
InChIKeyPGIXSIDBSQNVHA-UHFFFAOYSA-N
XLogP3.79
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.71
LogP ≤ 53.79
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

1-[6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]-N-methylmethanamine
CID 103175444
N-ethyl-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyridin-2-amine
CID 103176293
2-chloro-6-(2-ethylphenoxy)pyridine
CID 60726953
2-chloro-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-4-(trifluoromethyl)pyridine
CID 103174626
2,4-dichloro-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-1,3,5-triazine
CID 103174578
2-(chloromethyl)-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrazine
CID 103175405
4-chloro-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-(trifluoromethyl)pyrimidine
CID 106766872
[6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-methyl-3-pyridinyl]methanamine
CID 103175479
6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidin-4-amine
CID 103176295
3,6-dichloro-5-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-1,2,4-triazine
CID 103174589
3-[2-(chloromethyl)-3-fluorophenoxy]-2-ethyl-6-methylpyridine
CID 114065574
6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine
CID 103176389

Frequently Asked Questions

What is the IUPAC name of 3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine?
The IUPAC name of 3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine (CID 103174660) is 3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine.
What is the SMILES notation for 3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine?
The canonical SMILES for 3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine is CCc1nc(C)ccc1Oc1cccc(Cl)n1.
What is the InChIKey of 3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine?
The InChIKey is PGIXSIDBSQNVHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN2O/c1-3-10-11(8-7-9(2)15-10)17-13-6-4-5-12(14)16-13/h4-8H,3H2,1-2H3.
What are the key properties of 3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine?
3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine has a molecular weight of 248.71 g/mol, XLogP of 3.79, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-chloro-2-pyridinyl)oxy]-2-ethyl-6-methylpyridine is sourced from PubChem (CID 103174660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).