3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide

C15H12N2O4 — CID 145472125

IUPAC3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide
SMILESO=C1COc2ccc(NC(=O)c3cccc(O)c3)cc2N1
InChIInChI=1S/C15H12N2O4/c18-11-3-1-2-9(6-11)15(20)16-10-4-5-13-12(7-10)17-14(19)8-21-13/h1-7,18H,8H2,(H,16,20)(H,17,19)
InChIKeyOSJCAIZEFONLDX-UHFFFAOYSA-N
MW284.27 g/mol
LogP1.98
Rot. Bonds2

About 3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide

3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide (PubChem CID 145472125) has the molecular formula C15H12N2O4 and a molecular weight of 284.27 g/mol. Its IUPAC name is 3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide.

Molecular Properties

Compound Name3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide
PubChem CID145472125
Molecular FormulaC15H12N2O4
Molecular Weight284.27 g/mol
Exact Mass284.08
IUPAC Name3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide
SMILESO=C1COc2ccc(NC(=O)c3cccc(O)c3)cc2N1
InChIInChI=1S/C15H12N2O4/c18-11-3-1-2-9(6-11)15(20)16-10-4-5-13-12(7-10)17-14(19)8-21-13/h1-7,18H,8H2,(H,16,20)(H,17,19)
InChIKeyOSJCAIZEFONLDX-UHFFFAOYSA-N
XLogP1.98
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.27
LogP ≤ 51.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-(dimethylamino)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide
CID 51153492
N-(3-oxo-4H-1,4-benzoxazin-6-yl)-3-(1H-pyrazol-5-yl)benzamide
CID 59802884
3-oxo-N-phenyl-4H-1,4-benzoxazine-6-carboxamide
CID 17429970
N-(4-acetamidophenyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide
CID 53023831
N-(4-acetylphenyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide
CID 110763806
3-oxo-N-pyridin-4-yl-4H-1,4-benzoxazine-6-carboxamide
CID 53023811
N-(3-oxo-4H-1,4-benzoxazin-6-yl)pyridine-2-carboxamide
CID 51153474
2,3,4,5-tetrafluoro-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide
CID 32974831
N-[4-(furan-2-carbonylamino)phenyl]-3-oxo-4H-1,4-benzoxazine-6-carboxamide
CID 55504919
3-chloro-N-(4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-7-yl)benzamide
CID 110778268
N-(3-oxo-4H-1,4-benzoxazin-6-yl)-1-benzofuran-2-carboxamide
CID 51153472
N-(3-oxo-4H-1,4-benzoxazin-6-yl)-5-sulfamoylthiophene-3-carboxamide
CID 55462745

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide?
The IUPAC name of 3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide (CID 145472125) is 3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide.
What is the SMILES notation for 3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide?
The canonical SMILES for 3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide is O=C1COc2ccc(NC(=O)c3cccc(O)c3)cc2N1.
What is the InChIKey of 3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide?
The InChIKey is OSJCAIZEFONLDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O4/c18-11-3-1-2-9(6-11)15(20)16-10-4-5-13-12(7-10)17-14(19)8-21-13/h1-7,18H,8H2,(H,16,20)(H,17,19).
What are the key properties of 3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide?
3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide has a molecular weight of 284.27 g/mol, XLogP of 1.98, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide is sourced from PubChem (CID 145472125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).