3-(6-methoxynaphthalen-2-yl)-4-methylpyridine

C17H15NO — CID 25034430

IUPAC3-(6-methoxynaphthalen-2-yl)-4-methylpyridine
SMILESCOc1ccc2cc(-c3cnccc3C)ccc2c1
InChIInChI=1S/C17H15NO/c1-12-7-8-18-11-17(12)15-4-3-14-10-16(19-2)6-5-13(14)9-15/h3-11H,1-2H3
InChIKeyDBZOUPBQQHJUKL-UHFFFAOYSA-N
MW249.31 g/mol
LogP4.22
Rot. Bonds2

About 3-(6-methoxynaphthalen-2-yl)-4-methylpyridine

3-(6-methoxynaphthalen-2-yl)-4-methylpyridine (PubChem CID 25034430) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is 3-(6-methoxynaphthalen-2-yl)-4-methylpyridine.

Molecular Properties

Compound Name3-(6-methoxynaphthalen-2-yl)-4-methylpyridine
PubChem CID25034430
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name3-(6-methoxynaphthalen-2-yl)-4-methylpyridine
SMILESCOc1ccc2cc(-c3cnccc3C)ccc2c1
InChIInChI=1S/C17H15NO/c1-12-7-8-18-11-17(12)15-4-3-14-10-16(19-2)6-5-13(14)9-15/h3-11H,1-2H3
InChIKeyDBZOUPBQQHJUKL-UHFFFAOYSA-N
XLogP4.22
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(6-methoxynaphthalen-2-yl)-4-methylpyridine?
The IUPAC name of 3-(6-methoxynaphthalen-2-yl)-4-methylpyridine (CID 25034430) is 3-(6-methoxynaphthalen-2-yl)-4-methylpyridine.
What is the SMILES notation for 3-(6-methoxynaphthalen-2-yl)-4-methylpyridine?
The canonical SMILES for 3-(6-methoxynaphthalen-2-yl)-4-methylpyridine is COc1ccc2cc(-c3cnccc3C)ccc2c1.
What is the InChIKey of 3-(6-methoxynaphthalen-2-yl)-4-methylpyridine?
The InChIKey is DBZOUPBQQHJUKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO/c1-12-7-8-18-11-17(12)15-4-3-14-10-16(19-2)6-5-13(14)9-15/h3-11H,1-2H3.
What are the key properties of 3-(6-methoxynaphthalen-2-yl)-4-methylpyridine?
3-(6-methoxynaphthalen-2-yl)-4-methylpyridine has a molecular weight of 249.31 g/mol, XLogP of 4.22, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methoxynaphthalen-2-yl)-4-methylpyridine is sourced from PubChem (CID 25034430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).