3-formyl-2-oxo-1-phenylquinolin-4-olate

C16H10NO3- — CID 51371497

IUPAC3-formyl-2-oxo-1-phenylquinolin-4-olate
SMILESO=Cc1c([O-])c2ccccc2n(-c2ccccc2)c1=O
InChIInChI=1S/C16H11NO3/c18-10-13-15(19)12-8-4-5-9-14(12)17(16(13)20)11-6-2-1-3-7-11/h1-10,19H/p-1
InChIKeyOAQKDDWJZDKCER-UHFFFAOYSA-M
MW264.26 g/mol
LogP1.88
Rot. Bonds2

About 3-formyl-2-oxo-1-phenylquinolin-4-olate

3-formyl-2-oxo-1-phenylquinolin-4-olate (PubChem CID 51371497) has the molecular formula C16H10NO3- and a molecular weight of 264.26 g/mol. Its IUPAC name is 3-formyl-2-oxo-1-phenylquinolin-4-olate.

Molecular Properties

Compound Name3-formyl-2-oxo-1-phenylquinolin-4-olate
PubChem CID51371497
Molecular FormulaC16H10NO3-
Molecular Weight264.26 g/mol
Exact Mass264.07
IUPAC Name3-formyl-2-oxo-1-phenylquinolin-4-olate
SMILESO=Cc1c([O-])c2ccccc2n(-c2ccccc2)c1=O
InChIInChI=1S/C16H11NO3/c18-10-13-15(19)12-8-4-5-9-14(12)17(16(13)20)11-6-2-1-3-7-11/h1-10,19H/p-1
InChIKeyOAQKDDWJZDKCER-UHFFFAOYSA-M
XLogP1.88
TPSA62.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.26
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

3-ethyl-4-hydroxy-1-phenylquinolin-2-one
CID 54677985
4-hydroxy-1-phenyl-3-phenylsulfanylquinolin-2-one
CID 54685600
4-hydroxy-3-[5-(4-hydroxy-2-oxo-1-phenylquinolin-3-yl)pentyl]-1-phenylquinolin-2-one
CID 110273136
10-carbazol-9-ylanthracene-9-carbaldehyde
CID 134598541
4-hydroxy-3-(4-hydroxy-2-oxo-1-phenylquinolin-3-yl)sulfanyl-1-phenylquinolin-2-one
CID 102581403
3-ethyl-4-(methylamino)-1-phenylquinolin-2-one
CID 123908561
3-(benzenesulfonyl)-4-hydroxy-1-phenylquinolin-2-one
CID 54705173
3-[N-[2-(dihydroxyamino)phenyl]-C-methylcarbonimidoyl]-2-oxo-1-phenylquinolin-4-olate
CID 163125233
4-(2-oxo-1-phenylquinolin-4-yl)-1-phenylquinolin-2-one
CID 11503080
5-[4-[4-(6-oxophenanthridin-5-yl)phenyl]phenyl]phenanthridin-6-one
CID 86007842
4-phenylselenopheno[2,3-b]indole-2-carbaldehyde
CID 155771417
1-(4-hydroxyphenyl)-2-methylindole-3-carbaldehyde
CID 87772568

Frequently Asked Questions

What is the IUPAC name of 3-formyl-2-oxo-1-phenylquinolin-4-olate?
The IUPAC name of 3-formyl-2-oxo-1-phenylquinolin-4-olate (CID 51371497) is 3-formyl-2-oxo-1-phenylquinolin-4-olate.
What is the SMILES notation for 3-formyl-2-oxo-1-phenylquinolin-4-olate?
The canonical SMILES for 3-formyl-2-oxo-1-phenylquinolin-4-olate is O=Cc1c([O-])c2ccccc2n(-c2ccccc2)c1=O.
What is the InChIKey of 3-formyl-2-oxo-1-phenylquinolin-4-olate?
The InChIKey is OAQKDDWJZDKCER-UHFFFAOYSA-M. The full InChI is InChI=1S/C16H11NO3/c18-10-13-15(19)12-8-4-5-9-14(12)17(16(13)20)11-6-2-1-3-7-11/h1-10,19H/p-1.
What are the key properties of 3-formyl-2-oxo-1-phenylquinolin-4-olate?
3-formyl-2-oxo-1-phenylquinolin-4-olate has a molecular weight of 264.26 g/mol, XLogP of 1.88, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-formyl-2-oxo-1-phenylquinolin-4-olate is sourced from PubChem (CID 51371497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).