2-(4-phenoxyphenyl)quinoline

C21H15NO — CID 1482092

IUPAC2-(4-phenoxyphenyl)quinoline
SMILESc1ccc(Oc2ccc(-c3ccc4ccccc4n3)cc2)cc1
InChIInChI=1S/C21H15NO/c1-2-7-18(8-3-1)23-19-13-10-17(11-14-19)21-15-12-16-6-4-5-9-20(16)22-21/h1-15H
InChIKeyRRHQEDQRRLCSHA-UHFFFAOYSA-N
MW297.36 g/mol
LogP5.69
Rot. Bonds3

About 2-(4-phenoxyphenyl)quinoline

2-(4-phenoxyphenyl)quinoline (PubChem CID 1482092) has the molecular formula C21H15NO and a molecular weight of 297.36 g/mol. Its IUPAC name is 2-(4-phenoxyphenyl)quinoline.

Molecular Properties

Compound Name2-(4-phenoxyphenyl)quinoline
PubChem CID1482092
Molecular FormulaC21H15NO
Molecular Weight297.36 g/mol
Exact Mass297.12
IUPAC Name2-(4-phenoxyphenyl)quinoline
SMILESc1ccc(Oc2ccc(-c3ccc4ccccc4n3)cc2)cc1
InChIInChI=1S/C21H15NO/c1-2-7-18(8-3-1)23-19-13-10-17(11-14-19)21-15-12-16-6-4-5-9-20(16)22-21/h1-15H
InChIKeyRRHQEDQRRLCSHA-UHFFFAOYSA-N
XLogP5.69
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.36
LogP ≤ 55.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-phenoxyphenyl)quinoline?
The IUPAC name of 2-(4-phenoxyphenyl)quinoline (CID 1482092) is 2-(4-phenoxyphenyl)quinoline.
What is the SMILES notation for 2-(4-phenoxyphenyl)quinoline?
The canonical SMILES for 2-(4-phenoxyphenyl)quinoline is c1ccc(Oc2ccc(-c3ccc4ccccc4n3)cc2)cc1.
What is the InChIKey of 2-(4-phenoxyphenyl)quinoline?
The InChIKey is RRHQEDQRRLCSHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15NO/c1-2-7-18(8-3-1)23-19-13-10-17(11-14-19)21-15-12-16-6-4-5-9-20(16)22-21/h1-15H.
What are the key properties of 2-(4-phenoxyphenyl)quinoline?
2-(4-phenoxyphenyl)quinoline has a molecular weight of 297.36 g/mol, XLogP of 5.69, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenoxyphenyl)quinoline is sourced from PubChem (CID 1482092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).