6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol

C10H9FN2O2 — CID 136998707

IUPAC6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol
SMILESCc1ccc(-c2cc(N)on2)c(O)c1F
InChIInChI=1S/C10H9FN2O2/c1-5-2-3-6(10(14)9(5)11)7-4-8(12)15-13-7/h2-4,14H,12H2,1H3
InChIKeyOYRKWQMQAXKZQT-UHFFFAOYSA-N
MW208.19 g/mol
LogP2.08
Rot. Bonds1

About 6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol

6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol (PubChem CID 136998707) has the molecular formula C10H9FN2O2 and a molecular weight of 208.19 g/mol. Its IUPAC name is 6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol.

Molecular Properties

Compound Name6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol
PubChem CID136998707
Molecular FormulaC10H9FN2O2
Molecular Weight208.19 g/mol
Exact Mass208.06
IUPAC Name6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol
SMILESCc1ccc(-c2cc(N)on2)c(O)c1F
InChIInChI=1S/C10H9FN2O2/c1-5-2-3-6(10(14)9(5)11)7-4-8(12)15-13-7/h2-4,14H,12H2,1H3
InChIKeyOYRKWQMQAXKZQT-UHFFFAOYSA-N
XLogP2.08
TPSA72.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.19
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol?
The IUPAC name of 6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol (CID 136998707) is 6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol.
What is the SMILES notation for 6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol?
The canonical SMILES for 6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol is Cc1ccc(-c2cc(N)on2)c(O)c1F.
What is the InChIKey of 6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol?
The InChIKey is OYRKWQMQAXKZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O2/c1-5-2-3-6(10(14)9(5)11)7-4-8(12)15-13-7/h2-4,14H,12H2,1H3.
What are the key properties of 6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol?
6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol has a molecular weight of 208.19 g/mol, XLogP of 2.08, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol is sourced from PubChem (CID 136998707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).