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

C10H9FN2O2 — CID 136998720

IUPAC2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol
SMILESCc1ccc(F)c(-c2cc(N)no2)c1O
InChIInChI=1S/C10H9FN2O2/c1-5-2-3-6(11)9(10(5)14)7-4-8(12)13-15-7/h2-4,14H,1H3,(H2,12,13)
InChIKeyKWARHVBDTMPULF-UHFFFAOYSA-N
MW208.19 g/mol
LogP2.08
Rot. Bonds1

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

2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol (PubChem CID 136998720) has the molecular formula C10H9FN2O2 and a molecular weight of 208.19 g/mol. Its IUPAC name is 2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol.

Molecular Properties

Compound Name2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol
PubChem CID136998720
Molecular FormulaC10H9FN2O2
Molecular Weight208.19 g/mol
Exact Mass208.06
IUPAC Name2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol
SMILESCc1ccc(F)c(-c2cc(N)no2)c1O
InChIInChI=1S/C10H9FN2O2/c1-5-2-3-6(11)9(10(5)14)7-4-8(12)13-15-7/h2-4,14H,1H3,(H2,12,13)
InChIKeyKWARHVBDTMPULF-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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Related Compounds

2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methoxyphenol
CID 136968457
3-(3-amino-1,2-oxazol-5-yl)-2,4-difluorophenol
CID 117302447
5-(4-fluoro-3-methylphenyl)-1,2-oxazol-3-amine
CID 64983047
2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol
CID 136993784
5-[2-(dimethylamino)-3,6-difluorophenyl]-1,2-oxazol-3-amine
CID 115111734
5-(6-chloro-2-fluoro-3-methylphenyl)-1,2-oxazol-3-amine
CID 117325876
3-(3-amino-1,2-oxazol-5-yl)-5-chloro-4-fluorobenzene-1,2-diol
CID 137011505
5-(2-fluoro-6-methylsulfanylphenyl)-1,2-oxazol-3-amine
CID 117321679
3-(3-amino-1,2-oxazol-5-yl)-4-bromo-2,6-dimethylphenol
CID 117454901
3-(3-amino-1,2-oxazol-5-yl)-5-bromo-4-fluorobenzene-1,2-diol
CID 136968361
5-(2,3,4-trifluorophenyl)-1,2-oxazol-3-amine
CID 79754981
5-(6-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)-1,2-oxazol-3-amine
CID 117344208

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol?
The IUPAC name of 2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol (CID 136998720) is 2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol.
What is the SMILES notation for 2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol?
The canonical SMILES for 2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol is Cc1ccc(F)c(-c2cc(N)no2)c1O.
What is the InChIKey of 2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol?
The InChIKey is KWARHVBDTMPULF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O2/c1-5-2-3-6(11)9(10(5)14)7-4-8(12)13-15-7/h2-4,14H,1H3,(H2,12,13).
What are the key properties of 2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol?
2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-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 2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol is sourced from PubChem (CID 136998720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).