6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol

C10H9FN2O3 — CID 117321291

IUPAC6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol
SMILESCOc1c(F)ccc(-c2cnoc2N)c1O
InChIInChI=1S/C10H9FN2O3/c1-15-9-7(11)3-2-5(8(9)14)6-4-13-16-10(6)12/h2-4,14H,12H2,1H3
InChIKeyVFRATMIGYQSETG-UHFFFAOYSA-N
MW224.19 g/mol
LogP1.78
Rot. Bonds2

About 6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol

6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol (PubChem CID 117321291) has the molecular formula C10H9FN2O3 and a molecular weight of 224.19 g/mol. Its IUPAC name is 6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol.

Molecular Properties

Compound Name6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol
PubChem CID117321291
Molecular FormulaC10H9FN2O3
Molecular Weight224.19 g/mol
Exact Mass224.06
IUPAC Name6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol
SMILESCOc1c(F)ccc(-c2cnoc2N)c1O
InChIInChI=1S/C10H9FN2O3/c1-15-9-7(11)3-2-5(8(9)14)6-4-13-16-10(6)12/h2-4,14H,12H2,1H3
InChIKeyVFRATMIGYQSETG-UHFFFAOYSA-N
XLogP1.78
TPSA81.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.19
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-Methoxyphenyl)isoxazol-5-amine
CID 61393224
4-(5-Fluoro-2-methoxyphenyl)-1,2-oxazol-5-amine
CID 82113045
4-(2,4,5-Trifluoro-3-methoxyphenyl)-1,2-oxazol-5-amine
CID 115112274
3-(5-Amino-1,2-oxazol-4-yl)-4-fluorophenol
CID 117284260
5-(5-Amino-1,2-oxazol-4-yl)-4-fluoro-2-methylphenol
CID 117297099
6-(5-Amino-1,2-oxazol-4-yl)-2-fluoro-3-methylphenol
CID 117297103
4-(3-Fluoro-5-methoxyphenyl)-1,2-oxazol-5-amine
CID 117297105
2-(5-Amino-1,2-oxazol-4-yl)-6-fluoro-3-methylphenol
CID 117297106
2-(5-Amino-1,2-oxazol-4-yl)-4-fluoro-3-methylphenol
CID 117297108
4-(4-Fluoro-2-methoxyphenyl)-1,2-oxazol-5-amine
CID 117297113
4-(4-Fluoro-3-methoxyphenyl)-1,2-oxazol-5-amine
CID 117297114
4-(3-Fluoro-2-methoxyphenyl)-1,2-oxazol-5-amine
CID 117297115

Frequently Asked Questions

What is the IUPAC name of 6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol?
The IUPAC name of 6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol (CID 117321291) is 6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol.
What is the SMILES notation for 6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol?
The canonical SMILES for 6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol is COc1c(F)ccc(-c2cnoc2N)c1O.
What is the InChIKey of 6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol?
The InChIKey is VFRATMIGYQSETG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O3/c1-15-9-7(11)3-2-5(8(9)14)6-4-13-16-10(6)12/h2-4,14H,12H2,1H3.
What are the key properties of 6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol?
6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol has a molecular weight of 224.19 g/mol, XLogP of 1.78, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-amino-1,2-oxazol-4-yl)-3-fluoro-2-methoxyphenol is sourced from PubChem (CID 117321291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).