4-[(5-methoxy-2-methylphenoxy)methyl]pyridine

C14H15NO2 — CID 46937073

IUPAC4-[(5-methoxy-2-methylphenoxy)methyl]pyridine
SMILESCOc1ccc(C)c(OCc2ccncc2)c1
InChIInChI=1S/C14H15NO2/c1-11-3-4-13(16-2)9-14(11)17-10-12-5-7-15-8-6-12/h3-9H,10H2,1-2H3
InChIKeyMBHBRRBLXCXQKV-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.98
Rot. Bonds4

About 4-[(5-methoxy-2-methylphenoxy)methyl]pyridine

4-[(5-methoxy-2-methylphenoxy)methyl]pyridine (PubChem CID 46937073) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 4-[(5-methoxy-2-methylphenoxy)methyl]pyridine.

Molecular Properties

Compound Name4-[(5-methoxy-2-methylphenoxy)methyl]pyridine
PubChem CID46937073
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name4-[(5-methoxy-2-methylphenoxy)methyl]pyridine
SMILESCOc1ccc(C)c(OCc2ccncc2)c1
InChIInChI=1S/C14H15NO2/c1-11-3-4-13(16-2)9-14(11)17-10-12-5-7-15-8-6-12/h3-9H,10H2,1-2H3
InChIKeyMBHBRRBLXCXQKV-UHFFFAOYSA-N
XLogP2.98
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[(5-methoxy-2-methylphenoxy)methyl]pyridine 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 4-[(5-methoxy-2-methylphenoxy)methyl]pyridine?
The IUPAC name of 4-[(5-methoxy-2-methylphenoxy)methyl]pyridine (CID 46937073) is 4-[(5-methoxy-2-methylphenoxy)methyl]pyridine.
What is the SMILES notation for 4-[(5-methoxy-2-methylphenoxy)methyl]pyridine?
The canonical SMILES for 4-[(5-methoxy-2-methylphenoxy)methyl]pyridine is COc1ccc(C)c(OCc2ccncc2)c1.
What is the InChIKey of 4-[(5-methoxy-2-methylphenoxy)methyl]pyridine?
The InChIKey is MBHBRRBLXCXQKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-11-3-4-13(16-2)9-14(11)17-10-12-5-7-15-8-6-12/h3-9H,10H2,1-2H3.
What are the key properties of 4-[(5-methoxy-2-methylphenoxy)methyl]pyridine?
4-[(5-methoxy-2-methylphenoxy)methyl]pyridine has a molecular weight of 229.28 g/mol, XLogP of 2.98, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-methoxy-2-methylphenoxy)methyl]pyridine is sourced from PubChem (CID 46937073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).