4-(4-methoxyphenyl)-2-phenylquinoline

C22H17NO — CID 12523263

IUPAC4-(4-methoxyphenyl)-2-phenylquinoline
SMILESCOc1ccc(-c2cc(-c3ccccc3)nc3ccccc23)cc1
InChIInChI=1S/C22H17NO/c1-24-18-13-11-16(12-14-18)20-15-22(17-7-3-2-4-8-17)23-21-10-6-5-9-19(20)21/h2-15H,1H3
InChIKeyXQIAOHPOZRNPRH-UHFFFAOYSA-N
MW311.38 g/mol
LogP5.58
Rot. Bonds3

About 4-(4-methoxyphenyl)-2-phenylquinoline

4-(4-methoxyphenyl)-2-phenylquinoline (PubChem CID 12523263) has the molecular formula C22H17NO and a molecular weight of 311.38 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-2-phenylquinoline.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-2-phenylquinoline
PubChem CID12523263
Molecular FormulaC22H17NO
Molecular Weight311.38 g/mol
Exact Mass311.13
IUPAC Name4-(4-methoxyphenyl)-2-phenylquinoline
SMILESCOc1ccc(-c2cc(-c3ccccc3)nc3ccccc23)cc1
InChIInChI=1S/C22H17NO/c1-24-18-13-11-16(12-14-18)20-15-22(17-7-3-2-4-8-17)23-21-10-6-5-9-19(20)21/h2-15H,1H3
InChIKeyXQIAOHPOZRNPRH-UHFFFAOYSA-N
XLogP5.58
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.38
LogP ≤ 55.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-2-phenylquinoline?
The IUPAC name of 4-(4-methoxyphenyl)-2-phenylquinoline (CID 12523263) is 4-(4-methoxyphenyl)-2-phenylquinoline.
What is the SMILES notation for 4-(4-methoxyphenyl)-2-phenylquinoline?
The canonical SMILES for 4-(4-methoxyphenyl)-2-phenylquinoline is COc1ccc(-c2cc(-c3ccccc3)nc3ccccc23)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-2-phenylquinoline?
The InChIKey is XQIAOHPOZRNPRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17NO/c1-24-18-13-11-16(12-14-18)20-15-22(17-7-3-2-4-8-17)23-21-10-6-5-9-19(20)21/h2-15H,1H3.
What are the key properties of 4-(4-methoxyphenyl)-2-phenylquinoline?
4-(4-methoxyphenyl)-2-phenylquinoline has a molecular weight of 311.38 g/mol, XLogP of 5.58, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-2-phenylquinoline is sourced from PubChem (CID 12523263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).