1-benzyl-6-methoxy-4-phenylquinolin-2-one

C23H19NO2 — CID 166442700

IUPAC1-benzyl-6-methoxy-4-phenylquinolin-2-one
SMILESCOc1ccc2c(c1)c(-c1ccccc1)cc(=O)n2Cc1ccccc1
InChIInChI=1S/C23H19NO2/c1-26-19-12-13-22-21(14-19)20(18-10-6-3-7-11-18)15-23(25)24(22)16-17-8-4-2-5-9-17/h2-15H,16H2,1H3
InChIKeyVTOUPWFBMLDCTJ-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.73
Rot. Bonds4

About 1-benzyl-6-methoxy-4-phenylquinolin-2-one

1-benzyl-6-methoxy-4-phenylquinolin-2-one (PubChem CID 166442700) has the molecular formula C23H19NO2 and a molecular weight of 341.41 g/mol. Its IUPAC name is 1-benzyl-6-methoxy-4-phenylquinolin-2-one.

Molecular Properties

Compound Name1-benzyl-6-methoxy-4-phenylquinolin-2-one
PubChem CID166442700
Molecular FormulaC23H19NO2
Molecular Weight341.41 g/mol
Exact Mass341.14
IUPAC Name1-benzyl-6-methoxy-4-phenylquinolin-2-one
SMILESCOc1ccc2c(c1)c(-c1ccccc1)cc(=O)n2Cc1ccccc1
InChIInChI=1S/C23H19NO2/c1-26-19-12-13-22-21(14-19)20(18-10-6-3-7-11-18)15-23(25)24(22)16-17-8-4-2-5-9-17/h2-15H,16H2,1H3
InChIKeyVTOUPWFBMLDCTJ-UHFFFAOYSA-N
XLogP4.73
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-6-methoxy-4-phenylquinolin-2-one?
The IUPAC name of 1-benzyl-6-methoxy-4-phenylquinolin-2-one (CID 166442700) is 1-benzyl-6-methoxy-4-phenylquinolin-2-one.
What is the SMILES notation for 1-benzyl-6-methoxy-4-phenylquinolin-2-one?
The canonical SMILES for 1-benzyl-6-methoxy-4-phenylquinolin-2-one is COc1ccc2c(c1)c(-c1ccccc1)cc(=O)n2Cc1ccccc1.
What is the InChIKey of 1-benzyl-6-methoxy-4-phenylquinolin-2-one?
The InChIKey is VTOUPWFBMLDCTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO2/c1-26-19-12-13-22-21(14-19)20(18-10-6-3-7-11-18)15-23(25)24(22)16-17-8-4-2-5-9-17/h2-15H,16H2,1H3.
What are the key properties of 1-benzyl-6-methoxy-4-phenylquinolin-2-one?
1-benzyl-6-methoxy-4-phenylquinolin-2-one has a molecular weight of 341.41 g/mol, XLogP of 4.73, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-6-methoxy-4-phenylquinolin-2-one is sourced from PubChem (CID 166442700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).