3-[2-(2-methoxyethoxy)phenyl]pyridine

C14H15NO2 — CID 141192201

IUPAC3-[2-(2-methoxyethoxy)phenyl]pyridine
SMILESCOCCOc1ccccc1-c1cccnc1
InChIInChI=1S/C14H15NO2/c1-16-9-10-17-14-7-3-2-6-13(14)12-5-4-8-15-11-12/h2-8,11H,9-10H2,1H3
InChIKeyBFROQYPRSBRDBJ-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.77
Rot. Bonds5

About 3-[2-(2-methoxyethoxy)phenyl]pyridine

3-[2-(2-methoxyethoxy)phenyl]pyridine (PubChem CID 141192201) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 3-[2-(2-methoxyethoxy)phenyl]pyridine.

Molecular Properties

Compound Name3-[2-(2-methoxyethoxy)phenyl]pyridine
PubChem CID141192201
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name3-[2-(2-methoxyethoxy)phenyl]pyridine
SMILESCOCCOc1ccccc1-c1cccnc1
InChIInChI=1S/C14H15NO2/c1-16-9-10-17-14-7-3-2-6-13(14)12-5-4-8-15-11-12/h2-8,11H,9-10H2,1H3
InChIKeyBFROQYPRSBRDBJ-UHFFFAOYSA-N
XLogP2.77
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methoxyethoxy)phenyl]pyridine?
The IUPAC name of 3-[2-(2-methoxyethoxy)phenyl]pyridine (CID 141192201) is 3-[2-(2-methoxyethoxy)phenyl]pyridine.
What is the SMILES notation for 3-[2-(2-methoxyethoxy)phenyl]pyridine?
The canonical SMILES for 3-[2-(2-methoxyethoxy)phenyl]pyridine is COCCOc1ccccc1-c1cccnc1.
What is the InChIKey of 3-[2-(2-methoxyethoxy)phenyl]pyridine?
The InChIKey is BFROQYPRSBRDBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-16-9-10-17-14-7-3-2-6-13(14)12-5-4-8-15-11-12/h2-8,11H,9-10H2,1H3.
What are the key properties of 3-[2-(2-methoxyethoxy)phenyl]pyridine?
3-[2-(2-methoxyethoxy)phenyl]pyridine has a molecular weight of 229.28 g/mol, XLogP of 2.77, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-methoxyethoxy)phenyl]pyridine is sourced from PubChem (CID 141192201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).