6-methoxy-2-naphthalen-1-ylquinoline

C20H15NO — CID 164679227

IUPAC6-methoxy-2-naphthalen-1-ylquinoline
SMILESCOc1ccc2nc(-c3cccc4ccccc34)ccc2c1
InChIInChI=1S/C20H15NO/c1-22-16-10-12-19-15(13-16)9-11-20(21-19)18-8-4-6-14-5-2-3-7-17(14)18/h2-13H,1H3
InChIKeyDEUKCTJUJNTKAF-UHFFFAOYSA-N
MW285.35 g/mol
LogP5.06
Rot. Bonds2

About 6-methoxy-2-naphthalen-1-ylquinoline

6-methoxy-2-naphthalen-1-ylquinoline (PubChem CID 164679227) has the molecular formula C20H15NO and a molecular weight of 285.35 g/mol. Its IUPAC name is 6-methoxy-2-naphthalen-1-ylquinoline.

Molecular Properties

Compound Name6-methoxy-2-naphthalen-1-ylquinoline
PubChem CID164679227
Molecular FormulaC20H15NO
Molecular Weight285.35 g/mol
Exact Mass285.12
IUPAC Name6-methoxy-2-naphthalen-1-ylquinoline
SMILESCOc1ccc2nc(-c3cccc4ccccc34)ccc2c1
InChIInChI=1S/C20H15NO/c1-22-16-10-12-19-15(13-16)9-11-20(21-19)18-8-4-6-14-5-2-3-7-17(14)18/h2-13H,1H3
InChIKeyDEUKCTJUJNTKAF-UHFFFAOYSA-N
XLogP5.06
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.35
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-naphthalen-1-ylquinoline?
The IUPAC name of 6-methoxy-2-naphthalen-1-ylquinoline (CID 164679227) is 6-methoxy-2-naphthalen-1-ylquinoline.
What is the SMILES notation for 6-methoxy-2-naphthalen-1-ylquinoline?
The canonical SMILES for 6-methoxy-2-naphthalen-1-ylquinoline is COc1ccc2nc(-c3cccc4ccccc34)ccc2c1.
What is the InChIKey of 6-methoxy-2-naphthalen-1-ylquinoline?
The InChIKey is DEUKCTJUJNTKAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO/c1-22-16-10-12-19-15(13-16)9-11-20(21-19)18-8-4-6-14-5-2-3-7-17(14)18/h2-13H,1H3.
What are the key properties of 6-methoxy-2-naphthalen-1-ylquinoline?
6-methoxy-2-naphthalen-1-ylquinoline has a molecular weight of 285.35 g/mol, XLogP of 5.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-naphthalen-1-ylquinoline is sourced from PubChem (CID 164679227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).