2-(4-methoxyphenyl)quinoline

C16H13NO — CID 1481967

IUPAC2-(4-methoxyphenyl)quinoline
SMILESCOc1ccc(-c2ccc3ccccc3n2)cc1
InChIInChI=1S/C16H13NO/c1-18-14-9-6-13(7-10-14)16-11-8-12-4-2-3-5-15(12)17-16/h2-11H,1H3
InChIKeyNXYDIDCWFYLWKZ-UHFFFAOYSA-N
MW235.29 g/mol
LogP3.91
Rot. Bonds2

About 2-(4-methoxyphenyl)quinoline

2-(4-methoxyphenyl)quinoline (PubChem CID 1481967) has the molecular formula C16H13NO and a molecular weight of 235.29 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)quinoline.

Molecular Properties

Compound Name2-(4-methoxyphenyl)quinoline
PubChem CID1481967
Molecular FormulaC16H13NO
Molecular Weight235.29 g/mol
Exact Mass235.10
IUPAC Name2-(4-methoxyphenyl)quinoline
SMILESCOc1ccc(-c2ccc3ccccc3n2)cc1
InChIInChI=1S/C16H13NO/c1-18-14-9-6-13(7-10-14)16-11-8-12-4-2-3-5-15(12)17-16/h2-11H,1H3
InChIKeyNXYDIDCWFYLWKZ-UHFFFAOYSA-N
XLogP3.91
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)quinoline?
The IUPAC name of 2-(4-methoxyphenyl)quinoline (CID 1481967) is 2-(4-methoxyphenyl)quinoline.
What is the SMILES notation for 2-(4-methoxyphenyl)quinoline?
The canonical SMILES for 2-(4-methoxyphenyl)quinoline is COc1ccc(-c2ccc3ccccc3n2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)quinoline?
The InChIKey is NXYDIDCWFYLWKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO/c1-18-14-9-6-13(7-10-14)16-11-8-12-4-2-3-5-15(12)17-16/h2-11H,1H3.
What are the key properties of 2-(4-methoxyphenyl)quinoline?
2-(4-methoxyphenyl)quinoline has a molecular weight of 235.29 g/mol, XLogP of 3.91, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)quinoline is sourced from PubChem (CID 1481967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).