8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide

C16H12N2O3 — CID 56927662

IUPAC8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide
SMILESO=C(Nc1ccccc1)c1cc(=O)c2cccc(O)c2[nH]1
InChIInChI=1S/C16H12N2O3/c19-13-8-4-7-11-14(20)9-12(18-15(11)13)16(21)17-10-5-2-1-3-6-10/h1-9,19H,(H,17,21)(H,18,20)
InChIKeyWCONAUUNWGJNIE-UHFFFAOYSA-N
MW280.28 g/mol
LogP2.49
Rot. Bonds2

About 8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide

8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide (PubChem CID 56927662) has the molecular formula C16H12N2O3 and a molecular weight of 280.28 g/mol. Its IUPAC name is 8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide.

Molecular Properties

Compound Name8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide
PubChem CID56927662
Molecular FormulaC16H12N2O3
Molecular Weight280.28 g/mol
Exact Mass280.08
IUPAC Name8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide
SMILESO=C(Nc1ccccc1)c1cc(=O)c2cccc(O)c2[nH]1
InChIInChI=1S/C16H12N2O3/c19-13-8-4-7-11-14(20)9-12(18-15(11)13)16(21)17-10-5-2-1-3-6-10/h1-9,19H,(H,17,21)(H,18,20)
InChIKeyWCONAUUNWGJNIE-UHFFFAOYSA-N
XLogP2.49
TPSA82.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.28
LogP ≤ 52.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide?
The IUPAC name of 8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide (CID 56927662) is 8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide.
What is the SMILES notation for 8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide?
The canonical SMILES for 8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide is O=C(Nc1ccccc1)c1cc(=O)c2cccc(O)c2[nH]1.
What is the InChIKey of 8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide?
The InChIKey is WCONAUUNWGJNIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O3/c19-13-8-4-7-11-14(20)9-12(18-15(11)13)16(21)17-10-5-2-1-3-6-10/h1-9,19H,(H,17,21)(H,18,20).
What are the key properties of 8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide?
8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide has a molecular weight of 280.28 g/mol, XLogP of 2.49, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxy-4-oxo-N-phenyl-1H-quinoline-2-carboxamide is sourced from PubChem (CID 56927662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).