3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole

C15H9NO2 — CID 138857516

IUPAC3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole
SMILESc1ccc(-c2onc3c2oc2ccccc23)cc1
InChIInChI=1S/C15H9NO2/c1-2-6-10(7-3-1)14-15-13(16-18-14)11-8-4-5-9-12(11)17-15/h1-9H
InChIKeyXTDLISIFJWTQAP-UHFFFAOYSA-N
MW235.24 g/mol
LogP4.24
Rot. Bonds1

About 3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole

3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole (PubChem CID 138857516) has the molecular formula C15H9NO2 and a molecular weight of 235.24 g/mol. Its IUPAC name is 3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole.

Molecular Properties

Compound Name3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole
PubChem CID138857516
Molecular FormulaC15H9NO2
Molecular Weight235.24 g/mol
Exact Mass235.06
IUPAC Name3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole
SMILESc1ccc(-c2onc3c2oc2ccccc23)cc1
InChIInChI=1S/C15H9NO2/c1-2-6-10(7-3-1)14-15-13(16-18-14)11-8-4-5-9-12(11)17-15/h1-9H
InChIKeyXTDLISIFJWTQAP-UHFFFAOYSA-N
XLogP4.24
TPSA39.17 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole?
The IUPAC name of 3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole (CID 138857516) is 3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole.
What is the SMILES notation for 3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole?
The canonical SMILES for 3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole is c1ccc(-c2onc3c2oc2ccccc23)cc1.
What is the InChIKey of 3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole?
The InChIKey is XTDLISIFJWTQAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9NO2/c1-2-6-10(7-3-1)14-15-13(16-18-14)11-8-4-5-9-12(11)17-15/h1-9H.
What are the key properties of 3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole?
3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole has a molecular weight of 235.24 g/mol, XLogP of 4.24, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-[1]benzofuro[3,2-c][1,2]oxazole is sourced from PubChem (CID 138857516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).