2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide

C10H10N2O3 — CID 29083

💊View drug profile → caroxazone
IUPAC2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide
SMILESNC(=O)CN1Cc2ccccc2OC1=O
InChIInChI=1S/C10H10N2O3/c11-9(13)6-12-5-7-3-1-2-4-8(7)15-10(12)14/h1-4H,5-6H2,(H2,11,13)
InChIKeyKYCBWEZLKCTALM-UHFFFAOYSA-N
MW206.20 g/mol
LogP0.49
Rot. Bonds2

About 2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide

2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide (PubChem CID 29083) has the molecular formula C10H10N2O3 and a molecular weight of 206.20 g/mol. Its IUPAC name is 2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide
PubChem CID29083
Molecular FormulaC10H10N2O3
Molecular Weight206.20 g/mol
Exact Mass206.07
IUPAC Name2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide
SMILESNC(=O)CN1Cc2ccccc2OC1=O
InChIInChI=1S/C10H10N2O3/c11-9(13)6-12-5-7-3-1-2-4-8(7)15-10(12)14/h1-4H,5-6H2,(H2,11,13)
InChIKeyKYCBWEZLKCTALM-UHFFFAOYSA-N
XLogP0.49
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dihydro-2H-1,3-benzoxazin-2-one
CID 121020
2-(S)-Amino-4-(2-methoxy-benzylamino)-1-piperidin-1-yl-butan-1-one
CID 11150893
3-Benzyl-4-thioxo-1,3-benzoxazin-2-one
CID 46838382
2H-1,3-Benzoxazine-3(4H)-acetamide, 4-methyl-2-oxo-
CID 29084
2-(2-Sulfanylidene-2H-1,3-benzoxazin-3(4H)-yl)ethanimidic acid
CID 29085
Ammonium, (o-hydroxybenzyl)diethylmethyl-, iodide, dimethylcarbamate
CID 46001
Ethyl (2-oxo-2H-1,3-benzoxazin-3(4H)-yl)acetate
CID 209627
1-(2-Methoxybenzyl)piperazine-2,3-dione
CID 16027896
tert-butyl N-[2-[(2-methoxyphenyl)methylamino]ethyl]carbamate
CID 19597309
3,4-Dihydro-1H-9-oxa-1,4-diaza-phenanthrene-2,10-dione
CID 4183428
4-Ethoxy-3,4-dihydro-1,3-benzoxazin-2-one
CID 335807
2H-1,3-Benzoxazine-3(4H)-propionamide, 2-oxo-
CID 29082

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide?
The IUPAC name of 2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide (CID 29083) is 2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide.
What is the SMILES notation for 2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide?
The canonical SMILES for 2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide is NC(=O)CN1Cc2ccccc2OC1=O.
What is the InChIKey of 2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide?
The InChIKey is KYCBWEZLKCTALM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O3/c11-9(13)6-12-5-7-3-1-2-4-8(7)15-10(12)14/h1-4H,5-6H2,(H2,11,13).
What are the key properties of 2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide?
2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide has a molecular weight of 206.20 g/mol, XLogP of 0.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-4H-1,3-benzoxazin-3-yl)acetamide is sourced from PubChem (CID 29083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).