3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine

C18H19NO3 — CID 167460184

IUPAC3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine
SMILESCOc1ccc(COc2ncccc2C2=CCOCC2)cc1
InChIInChI=1S/C18H19NO3/c1-20-16-6-4-14(5-7-16)13-22-18-17(3-2-10-19-18)15-8-11-21-12-9-15/h2-8,10H,9,11-13H2,1H3
InChIKeyPRSUWMIYFADJSE-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.47
Rot. Bonds5

About 3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine

3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine (PubChem CID 167460184) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is 3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine.

Molecular Properties

Compound Name3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine
PubChem CID167460184
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC Name3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine
SMILESCOc1ccc(COc2ncccc2C2=CCOCC2)cc1
InChIInChI=1S/C18H19NO3/c1-20-16-6-4-14(5-7-16)13-22-18-17(3-2-10-19-18)15-8-11-21-12-9-15/h2-8,10H,9,11-13H2,1H3
InChIKeyPRSUWMIYFADJSE-UHFFFAOYSA-N
XLogP3.47
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]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 3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine?
The IUPAC name of 3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine (CID 167460184) is 3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine.
What is the SMILES notation for 3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine?
The canonical SMILES for 3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine is COc1ccc(COc2ncccc2C2=CCOCC2)cc1.
What is the InChIKey of 3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine?
The InChIKey is PRSUWMIYFADJSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-20-16-6-4-14(5-7-16)13-22-18-17(3-2-10-19-18)15-8-11-21-12-9-15/h2-8,10H,9,11-13H2,1H3.
What are the key properties of 3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine?
3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine has a molecular weight of 297.35 g/mol, XLogP of 3.47, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,6-dihydro-2H-pyran-4-yl)-2-[(4-methoxyphenyl)methoxy]pyridine is sourced from PubChem (CID 167460184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).