[4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol

C13H10FNO4 — CID 166368374

IUPAC[4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol
SMILESCOc1noc(CO)c1-c1cc2cccc(F)c2o1
InChIInChI=1S/C13H10FNO4/c1-17-13-11(10(6-16)19-15-13)9-5-7-3-2-4-8(14)12(7)18-9/h2-5,16H,6H2,1H3
InChIKeyGXXNNQJWRAODRW-UHFFFAOYSA-N
MW263.22 g/mol
LogP2.73
Rot. Bonds3

About [4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol

[4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol (PubChem CID 166368374) has the molecular formula C13H10FNO4 and a molecular weight of 263.22 g/mol. Its IUPAC name is [4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol.

Molecular Properties

Compound Name[4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol
PubChem CID166368374
Molecular FormulaC13H10FNO4
Molecular Weight263.22 g/mol
Exact Mass263.06
IUPAC Name[4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol
SMILESCOc1noc(CO)c1-c1cc2cccc(F)c2o1
InChIInChI=1S/C13H10FNO4/c1-17-13-11(10(6-16)19-15-13)9-5-7-3-2-4-8(14)12(7)18-9/h2-5,16H,6H2,1H3
InChIKeyGXXNNQJWRAODRW-UHFFFAOYSA-N
XLogP2.73
TPSA68.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.22
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol?
The IUPAC name of [4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol (CID 166368374) is [4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol.
What is the SMILES notation for [4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol?
The canonical SMILES for [4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol is COc1noc(CO)c1-c1cc2cccc(F)c2o1.
What is the InChIKey of [4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol?
The InChIKey is GXXNNQJWRAODRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FNO4/c1-17-13-11(10(6-16)19-15-13)9-5-7-3-2-4-8(14)12(7)18-9/h2-5,16H,6H2,1H3.
What are the key properties of [4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol?
[4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol has a molecular weight of 263.22 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(7-fluoro-1-benzofuran-2-yl)-3-methoxy-1,2-oxazol-5-yl]methanol is sourced from PubChem (CID 166368374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).