2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide

C12H9N3O3S — CID 2648676

IUPAC2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(Cn1c(=O)oc2ccccc21)Nc1nccs1
InChIInChI=1S/C12H9N3O3S/c16-10(14-11-13-5-6-19-11)7-15-8-3-1-2-4-9(8)18-12(15)17/h1-6H,7H2,(H,13,14,16)
InChIKeyKNYILEAUFJPRLK-UHFFFAOYSA-N
MW275.29 g/mol
LogP1.69
Rot. Bonds3

About 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide

2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 2648676) has the molecular formula C12H9N3O3S and a molecular weight of 275.29 g/mol. Its IUPAC name is 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide
PubChem CID2648676
Molecular FormulaC12H9N3O3S
Molecular Weight275.29 g/mol
Exact Mass275.04
IUPAC Name2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(Cn1c(=O)oc2ccccc21)Nc1nccs1
InChIInChI=1S/C12H9N3O3S/c16-10(14-11-13-5-6-19-11)7-15-8-3-1-2-4-9(8)18-12(15)17/h1-6H,7H2,(H,13,14,16)
InChIKeyKNYILEAUFJPRLK-UHFFFAOYSA-N
XLogP1.69
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.29
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 8036879
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 2220137
2-[4-(2-Ethoxy-phenyl)-piperazin-1-yl]-N-(5-methyl-thiazol-2-yl)-acetamide
CID 1443637
N-(4-Methoxy-phenyl)-N-{[(tetrahydro-furan-2-ylmethyl)-carbamoyl]-methyl}-N'-thiazol-2-yl-succinamide
CID 3205684
N-(4-methyl-1,3-thiazol-2-yl)-3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanamide
CID 3240832
N-[(2-Methoxy-ethylcarbamoyl)-methyl]-N-(2-methoxy-phenyl)-N'-thiazol-2-yl-succinamide
CID 649228
1-(2-ethoxyphenyl)-5-oxo-N-1,3-thiazol-2-yl-3-pyrrolidinecarboxamide
CID 2964458
N-(2-Methoxy-phenyl)-N-{[(tetrahydro-furan-2-ylmethyl)-carbamoyl]-methyl}-N'-thiazol-2-yl-succinamide
CID 3205682
N-(2-Ethoxy-phenyl)-N-{[(tetrahydro-furan-2-ylmethyl)-carbamoyl]-methyl}-N'-thiazol-2-yl-succinamide
CID 3205686
ethyl (2-{[(2-oxo-1,3-benzoxazol-3(2H)-yl)acetyl]amino}-1,3-thiazol-4-yl)acetate
CID 4243870
N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 8882267
2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-(5-nitro-1,3-thiazol-2-yl)acetamide
CID 101879982

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide (CID 2648676) is 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide is O=C(Cn1c(=O)oc2ccccc21)Nc1nccs1.
What is the InChIKey of 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is KNYILEAUFJPRLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O3S/c16-10(14-11-13-5-6-19-11)7-15-8-3-1-2-4-9(8)18-12(15)17/h1-6H,7H2,(H,13,14,16).
What are the key properties of 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide?
2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 275.29 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 2648676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).