2-oxo-1,4-benzoxazine-8-carboxamide

C9H6N2O3 — CID 140987274

IUPAC2-oxo-1,4-benzoxazine-8-carboxamide
SMILESNC(=O)c1cccc2ncc(=O)oc12
InChIInChI=1S/C9H6N2O3/c10-9(13)5-2-1-3-6-8(5)14-7(12)4-11-6/h1-4H,(H2,10,13)
InChIKeyGREVYIJPTKZRJG-UHFFFAOYSA-N
MW190.16 g/mol
LogP0.29
Rot. Bonds1

About 2-oxo-1,4-benzoxazine-8-carboxamide

2-oxo-1,4-benzoxazine-8-carboxamide (PubChem CID 140987274) has the molecular formula C9H6N2O3 and a molecular weight of 190.16 g/mol. Its IUPAC name is 2-oxo-1,4-benzoxazine-8-carboxamide.

Molecular Properties

Compound Name2-oxo-1,4-benzoxazine-8-carboxamide
PubChem CID140987274
Molecular FormulaC9H6N2O3
Molecular Weight190.16 g/mol
Exact Mass190.04
IUPAC Name2-oxo-1,4-benzoxazine-8-carboxamide
SMILESNC(=O)c1cccc2ncc(=O)oc12
InChIInChI=1S/C9H6N2O3/c10-9(13)5-2-1-3-6-8(5)14-7(12)4-11-6/h1-4H,(H2,10,13)
InChIKeyGREVYIJPTKZRJG-UHFFFAOYSA-N
XLogP0.29
TPSA86.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.16
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-1,4-benzoxazine-8-carboxamide?
The IUPAC name of 2-oxo-1,4-benzoxazine-8-carboxamide (CID 140987274) is 2-oxo-1,4-benzoxazine-8-carboxamide.
What is the SMILES notation for 2-oxo-1,4-benzoxazine-8-carboxamide?
The canonical SMILES for 2-oxo-1,4-benzoxazine-8-carboxamide is NC(=O)c1cccc2ncc(=O)oc12.
What is the InChIKey of 2-oxo-1,4-benzoxazine-8-carboxamide?
The InChIKey is GREVYIJPTKZRJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N2O3/c10-9(13)5-2-1-3-6-8(5)14-7(12)4-11-6/h1-4H,(H2,10,13).
What are the key properties of 2-oxo-1,4-benzoxazine-8-carboxamide?
2-oxo-1,4-benzoxazine-8-carboxamide has a molecular weight of 190.16 g/mol, XLogP of 0.29, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-1,4-benzoxazine-8-carboxamide is sourced from PubChem (CID 140987274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).