2-[(4-ethylphenoxy)methyl]-6-methoxypyridine

C15H17NO2 — CID 64763644

IUPAC2-[(4-ethylphenoxy)methyl]-6-methoxypyridine
SMILESCCc1ccc(OCc2cccc(OC)n2)cc1
InChIInChI=1S/C15H17NO2/c1-3-12-7-9-14(10-8-12)18-11-13-5-4-6-15(16-13)17-2/h4-10H,3,11H2,1-2H3
InChIKeyZCZGHTVDAJGWAB-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.23
Rot. Bonds5

About 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine

2-[(4-ethylphenoxy)methyl]-6-methoxypyridine (PubChem CID 64763644) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine.

Molecular Properties

Compound Name2-[(4-ethylphenoxy)methyl]-6-methoxypyridine
PubChem CID64763644
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name2-[(4-ethylphenoxy)methyl]-6-methoxypyridine
SMILESCCc1ccc(OCc2cccc(OC)n2)cc1
InChIInChI=1S/C15H17NO2/c1-3-12-7-9-14(10-8-12)18-11-13-5-4-6-15(16-13)17-2/h4-10H,3,11H2,1-2H3
InChIKeyZCZGHTVDAJGWAB-UHFFFAOYSA-N
XLogP3.23
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine?
The IUPAC name of 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine (CID 64763644) is 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine.
What is the SMILES notation for 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine?
The canonical SMILES for 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine is CCc1ccc(OCc2cccc(OC)n2)cc1.
What is the InChIKey of 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine?
The InChIKey is ZCZGHTVDAJGWAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-3-12-7-9-14(10-8-12)18-11-13-5-4-6-15(16-13)17-2/h4-10H,3,11H2,1-2H3.
What are the key properties of 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine?
2-[(4-ethylphenoxy)methyl]-6-methoxypyridine has a molecular weight of 243.31 g/mol, XLogP of 3.23, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine is sourced from PubChem (CID 64763644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).