4-anilino-2-phenylquinolin-8-ol

C21H16N2O — CID 91486521

IUPAC4-anilino-2-phenylquinolin-8-ol
SMILESOc1cccc2c(Nc3ccccc3)cc(-c3ccccc3)nc12
InChIInChI=1S/C21H16N2O/c24-20-13-7-12-17-19(22-16-10-5-2-6-11-16)14-18(23-21(17)20)15-8-3-1-4-9-15/h1-14,24H,(H,22,23)
InChIKeyBJXVXWSNTVUYMI-UHFFFAOYSA-N
MW312.37 g/mol
LogP5.35
Rot. Bonds3

About 4-anilino-2-phenylquinolin-8-ol

4-anilino-2-phenylquinolin-8-ol (PubChem CID 91486521) has the molecular formula C21H16N2O and a molecular weight of 312.37 g/mol. Its IUPAC name is 4-anilino-2-phenylquinolin-8-ol.

Molecular Properties

Compound Name4-anilino-2-phenylquinolin-8-ol
PubChem CID91486521
Molecular FormulaC21H16N2O
Molecular Weight312.37 g/mol
Exact Mass312.13
IUPAC Name4-anilino-2-phenylquinolin-8-ol
SMILESOc1cccc2c(Nc3ccccc3)cc(-c3ccccc3)nc12
InChIInChI=1S/C21H16N2O/c24-20-13-7-12-17-19(22-16-10-5-2-6-11-16)14-18(23-21(17)20)15-8-3-1-4-9-15/h1-14,24H,(H,22,23)
InChIKeyBJXVXWSNTVUYMI-UHFFFAOYSA-N
XLogP5.35
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.37
LogP ≤ 55.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-anilino-2-phenylquinolin-8-ol?
The IUPAC name of 4-anilino-2-phenylquinolin-8-ol (CID 91486521) is 4-anilino-2-phenylquinolin-8-ol.
What is the SMILES notation for 4-anilino-2-phenylquinolin-8-ol?
The canonical SMILES for 4-anilino-2-phenylquinolin-8-ol is Oc1cccc2c(Nc3ccccc3)cc(-c3ccccc3)nc12.
What is the InChIKey of 4-anilino-2-phenylquinolin-8-ol?
The InChIKey is BJXVXWSNTVUYMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O/c24-20-13-7-12-17-19(22-16-10-5-2-6-11-16)14-18(23-21(17)20)15-8-3-1-4-9-15/h1-14,24H,(H,22,23).
What are the key properties of 4-anilino-2-phenylquinolin-8-ol?
4-anilino-2-phenylquinolin-8-ol has a molecular weight of 312.37 g/mol, XLogP of 5.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-anilino-2-phenylquinolin-8-ol is sourced from PubChem (CID 91486521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).