4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide

C15H13N3O3 — CID 110763923

IUPAC4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide
SMILESCN1C(=O)COc2ccc(C(=O)Nc3ccccn3)cc21
InChIInChI=1S/C15H13N3O3/c1-18-11-8-10(5-6-12(11)21-9-14(18)19)15(20)17-13-4-2-3-7-16-13/h2-8H,9H2,1H3,(H,16,17,20)
InChIKeyHPMCKANEOGZCQU-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.69
Rot. Bonds2

About 4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide

4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide (PubChem CID 110763923) has the molecular formula C15H13N3O3 and a molecular weight of 283.29 g/mol. Its IUPAC name is 4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide.

Molecular Properties

Compound Name4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide
PubChem CID110763923
Molecular FormulaC15H13N3O3
Molecular Weight283.29 g/mol
Exact Mass283.10
IUPAC Name4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide
SMILESCN1C(=O)COc2ccc(C(=O)Nc3ccccn3)cc21
InChIInChI=1S/C15H13N3O3/c1-18-11-8-10(5-6-12(11)21-9-14(18)19)15(20)17-13-4-2-3-7-16-13/h2-8H,9H2,1H3,(H,16,17,20)
InChIKeyHPMCKANEOGZCQU-UHFFFAOYSA-N
XLogP1.69
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-difluorophenyl)-4-methyl-3-oxo-1,4-benzoxazine-6-carboxamide
CID 110763933
N-(4-acetylphenyl)-4-methyl-3-oxo-1,4-benzoxazine-6-carboxamide
CID 110763910
methyl 3-[(4-methyl-3-oxo-1,4-benzoxazine-6-carbonyl)amino]benzoate
CID 110763913
4-methyl-3-oxo-1,4-benzoxazine-6-carboxamide
CID 82492126
N-(3-chloro-4-methylphenyl)-4-methyl-3-oxo-1,4-benzoxazine-6-carboxamide
CID 110763897
2-[3-oxo-6-(pyrrolidine-1-carbonyl)-1,4-benzoxazin-4-yl]-N-pyridin-2-ylacetamide
CID 53004283
3-(4-methyl-3-oxo-1,4-benzoxazin-6-yl)-3-oxopropanoic acid
CID 116917982
N-(4-methyl-3-oxo-1,4-benzoxazin-6-yl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 166232237
N-(4-hydroxy-3-methoxyphenyl)-4-methyl-3-oxo-1,4-benzoxazine-6-carboxamide
CID 131934697
N-(2-methoxy-5-methylphenyl)-4-methyl-3-oxo-1,4-benzoxazine-6-carboxamide
CID 46286910
4-methyl-3-oxo-1,4-benzoxazine-6-carbonyl cyanide
CID 116918990
N-[5-[2-(dimethylamino)-2-oxoethyl]-1,3,4-thiadiazol-2-yl]-4-methyl-3-oxo-1,4-benzoxazine-6-carboxamide
CID 157015373

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide?
The IUPAC name of 4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide (CID 110763923) is 4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide.
What is the SMILES notation for 4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide?
The canonical SMILES for 4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide is CN1C(=O)COc2ccc(C(=O)Nc3ccccn3)cc21.
What is the InChIKey of 4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide?
The InChIKey is HPMCKANEOGZCQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3/c1-18-11-8-10(5-6-12(11)21-9-14(18)19)15(20)17-13-4-2-3-7-16-13/h2-8H,9H2,1H3,(H,16,17,20).
What are the key properties of 4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide?
4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide has a molecular weight of 283.29 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-oxo-N-pyridin-2-yl-1,4-benzoxazine-6-carboxamide is sourced from PubChem (CID 110763923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).