2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide

C16H11N3O4 — CID 30850600

IUPAC2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide
SMILESO=C(Cc1cc(-c2cc3ccccc3o2)on1)Nc1ccon1
InChIInChI=1S/C16H11N3O4/c20-16(17-15-5-6-21-19-15)9-11-8-14(23-18-11)13-7-10-3-1-2-4-12(10)22-13/h1-8H,9H2,(H,17,19,20)
InChIKeyAHTPLBFDWOCTHE-UHFFFAOYSA-N
MW309.28 g/mol
LogP3.26
Rot. Bonds4

About 2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide

2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide (PubChem CID 30850600) has the molecular formula C16H11N3O4 and a molecular weight of 309.28 g/mol. Its IUPAC name is 2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide
PubChem CID30850600
Molecular FormulaC16H11N3O4
Molecular Weight309.28 g/mol
Exact Mass309.07
IUPAC Name2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide
SMILESO=C(Cc1cc(-c2cc3ccccc3o2)on1)Nc1ccon1
InChIInChI=1S/C16H11N3O4/c20-16(17-15-5-6-21-19-15)9-11-8-14(23-18-11)13-7-10-3-1-2-4-12(10)22-13/h1-8H,9H2,(H,17,19,20)
InChIKeyAHTPLBFDWOCTHE-UHFFFAOYSA-N
XLogP3.26
TPSA94.30 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.28
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(2-methylsulfanylphenyl)acetamide
CID 30850586
N-(1,2-oxazol-3-yl)-2-(5-thiophen-2-yl-1,2-oxazol-3-yl)acetamide
CID 16879574
N-[[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide
CID 30608149
N-[[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]methyl]-2-(2-methoxyphenoxy)acetamide
CID 30608221
[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]methyl 2-oxochromene-3-carboxylate
CID 30608554
[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]methyl (2R)-2-phenoxypropanoate
CID 30608484
ethyl 5-(1-benzofuran-2-yl)-1,2-oxazole-3-carboxylate
CID 154791615
2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide
CID 6467231
N-(4-hydroxyphenyl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 155556405
3-[3-(1-benzofuran-2-yl)-1,2,4-oxadiazol-5-yl]-1,1-difluoropropan-2-one
CID 63344525
N-(4-methoxyphenyl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 16878325
4-[3-(1-benzofuran-2-yl)-1,2,4-oxadiazol-5-yl]butan-2-one
CID 63344483

Frequently Asked Questions

What is the IUPAC name of 2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide (CID 30850600) is 2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide is O=C(Cc1cc(-c2cc3ccccc3o2)on1)Nc1ccon1.
What is the InChIKey of 2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide?
The InChIKey is AHTPLBFDWOCTHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3O4/c20-16(17-15-5-6-21-19-15)9-11-8-14(23-18-11)13-7-10-3-1-2-4-12(10)22-13/h1-8H,9H2,(H,17,19,20).
What are the key properties of 2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide?
2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide has a molecular weight of 309.28 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 30850600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).