3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine

C15H17NO2 — CID 90168005

IUPAC3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine
SMILESCOCCOc1ccc(-c2cccnc2C)cc1
InChIInChI=1S/C15H17NO2/c1-12-15(4-3-9-16-12)13-5-7-14(8-6-13)18-11-10-17-2/h3-9H,10-11H2,1-2H3
InChIKeyKAFHLSIWCRLGOO-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.08
Rot. Bonds5

About 3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine

3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine (PubChem CID 90168005) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine.

Molecular Properties

Compound Name3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine
PubChem CID90168005
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine
SMILESCOCCOc1ccc(-c2cccnc2C)cc1
InChIInChI=1S/C15H17NO2/c1-12-15(4-3-9-16-12)13-5-7-14(8-6-13)18-11-10-17-2/h3-9H,10-11H2,1-2H3
InChIKeyKAFHLSIWCRLGOO-UHFFFAOYSA-N
XLogP3.08
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 ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine with MolForge

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

Launch Full Analysis

Related Compounds

3-[4-(methoxymethyl)phenyl]-2-methylpyridine
CID 90168009
ethane;3-[4-(methoxymethyl)phenyl]-2-methylpyridine
CID 144506103
1-(2-methoxyethoxy)-4-phenylbenzene
CID 20582782
2-methyl-3-(4-phenylphenyl)pyridine
CID 90167639
2-[[4-(2-methoxyethoxy)phenyl]methyl]pyrimidine
CID 151551370
3-[4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]phenyl]pyrano[2,3-b]pyridin-2-one
CID 162356734
2-methoxy-5-(2-methyl-3-pyridinyl)pyridine
CID 90167711
1-chloro-4-[4-[4-(2-methoxyethoxy)phenyl]phenyl]benzene
CID 71108634
S-[4-(2-methyl-3-pyridinyl)phenyl]thiohydroxylamine
CID 144505126
2-methyl-3-(2-phenoxyethoxy)pyridine
CID 59416564
4,7-bis[4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]phenyl]-2,1,3-benzothiadiazole
CID 166983283
4-[4-(2-methoxyethoxy)phenyl]-1-methylpyrazol-5-amine
CID 117370752

Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine?
The IUPAC name of 3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine (CID 90168005) is 3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine.
What is the SMILES notation for 3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine?
The canonical SMILES for 3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine is COCCOc1ccc(-c2cccnc2C)cc1.
What is the InChIKey of 3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine?
The InChIKey is KAFHLSIWCRLGOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-12-15(4-3-9-16-12)13-5-7-14(8-6-13)18-11-10-17-2/h3-9H,10-11H2,1-2H3.
What are the key properties of 3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine?
3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine has a molecular weight of 243.31 g/mol, XLogP of 3.08, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-methoxyethoxy)phenyl]-2-methylpyridine is sourced from PubChem (CID 90168005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).