N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide

C11H10N2O3 — CID 18350644

IUPACN-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide
SMILESCC(=O)Nc1ccc2c(=O)onc(C)c2c1
InChIInChI=1S/C11H10N2O3/c1-6-10-5-8(12-7(2)14)3-4-9(10)11(15)16-13-6/h3-5H,1-2H3,(H,12,14)
InChIKeyOVZWMWXECZGXQG-UHFFFAOYSA-N
MW218.21 g/mol
LogP1.45
Rot. Bonds1

About N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide

N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide (PubChem CID 18350644) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide.

Molecular Properties

Compound NameN-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide
PubChem CID18350644
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC NameN-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide
SMILESCC(=O)Nc1ccc2c(=O)onc(C)c2c1
InChIInChI=1S/C11H10N2O3/c1-6-10-5-8(12-7(2)14)3-4-9(10)11(15)16-13-6/h3-5H,1-2H3,(H,12,14)
InChIKeyOVZWMWXECZGXQG-UHFFFAOYSA-N
XLogP1.45
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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4-Acetamido-2-methylbenzoic acid
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2-Cyclohexylmethyl-2-hydroxy-4-methyl-4-phenyl-pentanoic acid (4-methyl-1-oxo-1H-benzo[d][1,2]oxazin-6-yl)-amide
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2-Methyl-4-((2-methylbenzoyl)amino)benzoic acid
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4-Acetamidobenzoate
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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide?
The IUPAC name of N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide (CID 18350644) is N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide.
What is the SMILES notation for N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide?
The canonical SMILES for N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide is CC(=O)Nc1ccc2c(=O)onc(C)c2c1.
What is the InChIKey of N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide?
The InChIKey is OVZWMWXECZGXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3/c1-6-10-5-8(12-7(2)14)3-4-9(10)11(15)16-13-6/h3-5H,1-2H3,(H,12,14).
What are the key properties of N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide?
N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide has a molecular weight of 218.21 g/mol, XLogP of 1.45, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)acetamide is sourced from PubChem (CID 18350644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).