5-(6-methoxynaphthalen-2-yl)-1-methylimidazole

C15H14N2O — CID 25172548

IUPAC5-(6-methoxynaphthalen-2-yl)-1-methylimidazole
SMILESCOc1ccc2cc(-c3cncn3C)ccc2c1
InChIInChI=1S/C15H14N2O/c1-17-10-16-9-15(17)13-4-3-12-8-14(18-2)6-5-11(12)7-13/h3-10H,1-2H3
InChIKeyKNUDUXPQZASXSE-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.25
Rot. Bonds2

About 5-(6-methoxynaphthalen-2-yl)-1-methylimidazole

5-(6-methoxynaphthalen-2-yl)-1-methylimidazole (PubChem CID 25172548) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 5-(6-methoxynaphthalen-2-yl)-1-methylimidazole.

Molecular Properties

Compound Name5-(6-methoxynaphthalen-2-yl)-1-methylimidazole
PubChem CID25172548
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name5-(6-methoxynaphthalen-2-yl)-1-methylimidazole
SMILESCOc1ccc2cc(-c3cncn3C)ccc2c1
InChIInChI=1S/C15H14N2O/c1-17-10-16-9-15(17)13-4-3-12-8-14(18-2)6-5-11(12)7-13/h3-10H,1-2H3
InChIKeyKNUDUXPQZASXSE-UHFFFAOYSA-N
XLogP3.25
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(6-methoxynaphthalen-2-yl)-1-methylimidazole?
The IUPAC name of 5-(6-methoxynaphthalen-2-yl)-1-methylimidazole (CID 25172548) is 5-(6-methoxynaphthalen-2-yl)-1-methylimidazole.
What is the SMILES notation for 5-(6-methoxynaphthalen-2-yl)-1-methylimidazole?
The canonical SMILES for 5-(6-methoxynaphthalen-2-yl)-1-methylimidazole is COc1ccc2cc(-c3cncn3C)ccc2c1.
What is the InChIKey of 5-(6-methoxynaphthalen-2-yl)-1-methylimidazole?
The InChIKey is KNUDUXPQZASXSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-17-10-16-9-15(17)13-4-3-12-8-14(18-2)6-5-11(12)7-13/h3-10H,1-2H3.
What are the key properties of 5-(6-methoxynaphthalen-2-yl)-1-methylimidazole?
5-(6-methoxynaphthalen-2-yl)-1-methylimidazole has a molecular weight of 238.29 g/mol, XLogP of 3.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-methoxynaphthalen-2-yl)-1-methylimidazole is sourced from PubChem (CID 25172548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).