2-oxo-4-phenyl-1H-quinolin-3-olate

C15H10NO2- — CID 102515036

IUPAC2-oxo-4-phenyl-1H-quinolin-3-olate
SMILESO=c1[nH]c2ccccc2c(-c2ccccc2)c1[O-]
InChIInChI=1S/C15H11NO2/c17-14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)16-15(14)18/h1-9,17H,(H,16,18)/p-1
InChIKeyQSRVMXWVVMILDI-UHFFFAOYSA-M
MW236.25 g/mol
LogP2.27
Rot. Bonds1

About 2-oxo-4-phenyl-1H-quinolin-3-olate

2-oxo-4-phenyl-1H-quinolin-3-olate (PubChem CID 102515036) has the molecular formula C15H10NO2- and a molecular weight of 236.25 g/mol. Its IUPAC name is 2-oxo-4-phenyl-1H-quinolin-3-olate.

Molecular Properties

Compound Name2-oxo-4-phenyl-1H-quinolin-3-olate
PubChem CID102515036
Molecular FormulaC15H10NO2-
Molecular Weight236.25 g/mol
Exact Mass236.07
IUPAC Name2-oxo-4-phenyl-1H-quinolin-3-olate
SMILESO=c1[nH]c2ccccc2c(-c2ccccc2)c1[O-]
InChIInChI=1S/C15H11NO2/c17-14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)16-15(14)18/h1-9,17H,(H,16,18)/p-1
InChIKeyQSRVMXWVVMILDI-UHFFFAOYSA-M
XLogP2.27
TPSA55.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.25
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-4-phenyl-1H-quinolin-3-olate?
The IUPAC name of 2-oxo-4-phenyl-1H-quinolin-3-olate (CID 102515036) is 2-oxo-4-phenyl-1H-quinolin-3-olate.
What is the SMILES notation for 2-oxo-4-phenyl-1H-quinolin-3-olate?
The canonical SMILES for 2-oxo-4-phenyl-1H-quinolin-3-olate is O=c1[nH]c2ccccc2c(-c2ccccc2)c1[O-].
What is the InChIKey of 2-oxo-4-phenyl-1H-quinolin-3-olate?
The InChIKey is QSRVMXWVVMILDI-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H11NO2/c17-14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)16-15(14)18/h1-9,17H,(H,16,18)/p-1.
What are the key properties of 2-oxo-4-phenyl-1H-quinolin-3-olate?
2-oxo-4-phenyl-1H-quinolin-3-olate has a molecular weight of 236.25 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-4-phenyl-1H-quinolin-3-olate is sourced from PubChem (CID 102515036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).