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

C10H9FN2O3 — CID 136968470

IUPAC4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol
SMILESCOc1cc(-c2cc(N)on2)c(F)cc1O
InChIInChI=1S/C10H9FN2O3/c1-15-9-2-5(6(11)3-8(9)14)7-4-10(12)16-13-7/h2-4,14H,12H2,1H3
InChIKeyFBASTEFRNJBHCA-UHFFFAOYSA-N
MW224.19 g/mol
LogP1.78
Rot. Bonds2

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

4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol (PubChem CID 136968470) has the molecular formula C10H9FN2O3 and a molecular weight of 224.19 g/mol. Its IUPAC name is 4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol.

Molecular Properties

Compound Name4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol
PubChem CID136968470
Molecular FormulaC10H9FN2O3
Molecular Weight224.19 g/mol
Exact Mass224.06
IUPAC Name4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol
SMILESCOc1cc(-c2cc(N)on2)c(F)cc1O
InChIInChI=1S/C10H9FN2O3/c1-15-9-2-5(6(11)3-8(9)14)7-4-10(12)16-13-7/h2-4,14H,12H2,1H3
InChIKeyFBASTEFRNJBHCA-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

2-(5-amino-1,2-oxazol-3-yl)-5-fluoro-4-methoxyphenol
CID 136968465
4-(5-amino-1,2-oxazol-3-yl)-5-bromo-2-methoxyphenol
CID 136931171
3-(5-bromo-2-fluoro-4-methoxyphenyl)-1,2-oxazol-5-amine
CID 117462618
3-(5-amino-1,2-oxazol-3-yl)-2,6-difluoro-5-methoxyphenol
CID 117356932
2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol
CID 136993797
3-(5-amino-1,2-oxazol-3-yl)-2,4-difluoro-5-methoxyphenol
CID 117356931
3-(4-bromo-2,5-dimethoxyphenyl)-1,2-oxazol-5-amine
CID 3407261
3-(4,5-dimethoxy-2-methylsulfanylphenyl)-1,2-oxazol-5-amine
CID 117419909
5-(5-amino-1,2-oxazol-3-yl)-3-fluoro-2-methoxy-6-methylphenol
CID 117348496
3-(2,5-dimethoxy-3,4-dimethylphenyl)-1,2-oxazol-5-amine
CID 117373551
5-(5-amino-1,2-oxazol-3-yl)-4-hydroxy-2-methoxybenzoic acid
CID 136998089
3-(5-fluoro-2-methoxy-4-methylsulfonylphenyl)-1,2-oxazol-5-amine
CID 117461612

Frequently Asked Questions

What is the IUPAC name of 4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol?
The IUPAC name of 4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol (CID 136968470) is 4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol.
What is the SMILES notation for 4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol?
The canonical SMILES for 4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol is COc1cc(-c2cc(N)on2)c(F)cc1O.
What is the InChIKey of 4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol?
The InChIKey is FBASTEFRNJBHCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O3/c1-15-9-2-5(6(11)3-8(9)14)7-4-10(12)16-13-7/h2-4,14H,12H2,1H3.
What are the key properties of 4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol?
4-(5-amino-1,2-oxazol-3-yl)-5-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 4-(5-amino-1,2-oxazol-3-yl)-5-fluoro-2-methoxyphenol is sourced from PubChem (CID 136968470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).