1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone

C15H11NO3 — CID 15353321

IUPAC1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone
SMILESCC(=O)c1ccc(-c2ncc(-c3ccccc3)o2)o1
InChIInChI=1S/C15H11NO3/c1-10(17)12-7-8-13(18-12)15-16-9-14(19-15)11-5-3-2-4-6-11/h2-9H,1H3
InChIKeyABVIHJPWUBOAQE-UHFFFAOYSA-N
MW253.26 g/mol
LogP3.80
Rot. Bonds3

About 1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone

1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone (PubChem CID 15353321) has the molecular formula C15H11NO3 and a molecular weight of 253.26 g/mol. Its IUPAC name is 1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone.

Molecular Properties

Compound Name1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone
PubChem CID15353321
Molecular FormulaC15H11NO3
Molecular Weight253.26 g/mol
Exact Mass253.07
IUPAC Name1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone
SMILESCC(=O)c1ccc(-c2ncc(-c3ccccc3)o2)o1
InChIInChI=1S/C15H11NO3/c1-10(17)12-7-8-13(18-12)15-16-9-14(19-15)11-5-3-2-4-6-11/h2-9H,1H3
InChIKeyABVIHJPWUBOAQE-UHFFFAOYSA-N
XLogP3.80
TPSA56.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(5-phenyl-1,3-oxazol-2-yl)phenyl] acetate
CID 24962592
[4-(2-phenyl-1,3-oxazol-5-yl)phenyl] acetate
CID 71501498
5-(4-methylphenyl)-2-phenyl-1,3-oxazole
CID 3946772
2-(4-iodophenyl)-5-phenyl-1,3-oxazole
CID 19894925
2-methoxy-5-phenyl-1,3-oxazole
CID 69332700
1-(5-phenylfuran-2-yl)propan-1-one
CID 62631331
2-(5-phenyl-1,3-oxazol-2-yl)propanoate
CID 57371463
sodium 5-phenyl-1,3-oxazole-2-carboxylate
CID 71755872
1-[2-(2-methoxyphenyl)-1,3-oxazol-5-yl]ethanone
CID 115087217
1-(5-phenyl-1,3-oxazol-2-yl)butan-1-one
CID 10943870
3-(5-phenyl-1,3-oxazol-2-yl)benzene-1,2-diol
CID 142748412
2-(5-phenyl-1,3-oxazole-2-carbonyl)benzoic acid
CID 134122364

Frequently Asked Questions

What is the IUPAC name of 1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone?
The IUPAC name of 1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone (CID 15353321) is 1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone.
What is the SMILES notation for 1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone?
The canonical SMILES for 1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone is CC(=O)c1ccc(-c2ncc(-c3ccccc3)o2)o1.
What is the InChIKey of 1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone?
The InChIKey is ABVIHJPWUBOAQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO3/c1-10(17)12-7-8-13(18-12)15-16-9-14(19-15)11-5-3-2-4-6-11/h2-9H,1H3.
What are the key properties of 1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone?
1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone has a molecular weight of 253.26 g/mol, XLogP of 3.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(5-phenyl-1,3-oxazol-2-yl)furan-2-yl]ethanone is sourced from PubChem (CID 15353321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).