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

C9H7FN2O2 — CID 137015317

IUPAC2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol
SMILESNc1cc(-c2cc(F)ccc2O)on1
InChIInChI=1S/C9H7FN2O2/c10-5-1-2-7(13)6(3-5)8-4-9(11)12-14-8/h1-4,13H,(H2,11,12)
InChIKeyUSCLYACYQJWSOT-UHFFFAOYSA-N
MW194.17 g/mol
LogP1.77
Rot. Bonds1

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

2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol (PubChem CID 137015317) has the molecular formula C9H7FN2O2 and a molecular weight of 194.17 g/mol. Its IUPAC name is 2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol.

Molecular Properties

Compound Name2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol
PubChem CID137015317
Molecular FormulaC9H7FN2O2
Molecular Weight194.17 g/mol
Exact Mass194.05
IUPAC Name2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol
SMILESNc1cc(-c2cc(F)ccc2O)on1
InChIInChI=1S/C9H7FN2O2/c10-5-1-2-7(13)6(3-5)8-4-9(11)12-14-8/h1-4,13H,(H2,11,12)
InChIKeyUSCLYACYQJWSOT-UHFFFAOYSA-N
XLogP1.77
TPSA72.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.17
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3-amino-1,2-oxazol-5-yl)-2,3-difluorophenol
CID 137013055
4-(3-amino-1,2-oxazol-5-yl)benzene-1,3-diol
CID 137015300
3-(3-amino-1,2-oxazol-5-yl)-2,4-difluorophenol
CID 117302447
6-(3-amino-1,2-oxazol-5-yl)-1,3-benzodioxol-5-ol
CID 136993765
6-(3-amino-1,2-oxazol-5-yl)-1,3-dihydro-2-benzofuran-5-ol
CID 137013109
5-(5-fluoro-2-piperidin-1-ylphenyl)-1,2-oxazol-3-amine
CID 117407236
2-(3-amino-1,2-oxazol-5-yl)-4-bromo-3-fluorophenol
CID 136932435
5-(2-chloro-3,5-difluorophenyl)-1,2-oxazol-3-amine
CID 117333114
5-(2,3,4-trifluorophenyl)-1,2-oxazol-3-amine
CID 79754981
5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol
CID 136968536
3-(3-amino-1,2-oxazol-5-yl)-2-fluoro-6-methoxyphenol
CID 117321250
5-(2-fluoro-5-methoxyphenyl)-1,2-oxazol-3-amine
CID 117297135

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol?
The IUPAC name of 2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol (CID 137015317) is 2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol.
What is the SMILES notation for 2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol?
The canonical SMILES for 2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol is Nc1cc(-c2cc(F)ccc2O)on1.
What is the InChIKey of 2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol?
The InChIKey is USCLYACYQJWSOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7FN2O2/c10-5-1-2-7(13)6(3-5)8-4-9(11)12-14-8/h1-4,13H,(H2,11,12).
What are the key properties of 2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol?
2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol has a molecular weight of 194.17 g/mol, XLogP of 1.77, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-1,2-oxazol-5-yl)-4-fluorophenol is sourced from PubChem (CID 137015317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).