3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine

C11H11FN2O — CID 117294555

IUPAC3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine
SMILESCc1cc(C)c(F)c(-c2cc(N)on2)c1
InChIInChI=1S/C11H11FN2O/c1-6-3-7(2)11(12)8(4-6)9-5-10(13)15-14-9/h3-5H,13H2,1-2H3
InChIKeyUYLZANXBNVLYLG-UHFFFAOYSA-N
MW206.22 g/mol
LogP2.68
Rot. Bonds1

About 3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine

3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine (PubChem CID 117294555) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is 3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine
PubChem CID117294555
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine
SMILESCc1cc(C)c(F)c(-c2cc(N)on2)c1
InChIInChI=1S/C11H11FN2O/c1-6-3-7(2)11(12)8(4-6)9-5-10(13)15-14-9/h3-5H,13H2,1-2H3
InChIKeyUYLZANXBNVLYLG-UHFFFAOYSA-N
XLogP2.68
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-chloro-2-fluoro-5-methylphenyl)-1,2-oxazol-5-amine
CID 117325884
2-(5-amino-1,2-oxazol-3-yl)-6-fluoro-4-methylphenol
CID 136998714
3-(2-chloro-3-fluoro-4-methylphenyl)-1,2-oxazol-5-amine
CID 117325881
6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol
CID 136998707
3-(5-chloro-2-fluoro-4-methylphenyl)-1,2-oxazol-5-amine
CID 117325886
3-(1,5,7-trimethylindol-3-yl)-1,2-oxazol-5-amine
CID 84741345
3-(4-fluoro-3-methoxy-5-methylphenyl)-1,2-oxazol-5-amine
CID 117317570
3-(2-bromo-3-methoxy-5-methylphenyl)-1,2-oxazol-5-amine
CID 117454853
3-(2,3,4,5,6-pentafluorophenyl)-1,2-oxazol-5-amine
CID 43608008
3-(5-amino-1,2-oxazol-3-yl)-2,6-difluoro-5-methoxyphenol
CID 117356932
2-(5-amino-1,2-oxazol-3-yl)-5-methylbenzene-1,4-diol
CID 136998676
3-(2-ethyl-5-methylphenyl)-1,2-oxazol-5-amine
CID 117290975

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine?
The IUPAC name of 3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine (CID 117294555) is 3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine?
The canonical SMILES for 3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine is Cc1cc(C)c(F)c(-c2cc(N)on2)c1.
What is the InChIKey of 3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine?
The InChIKey is UYLZANXBNVLYLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O/c1-6-3-7(2)11(12)8(4-6)9-5-10(13)15-14-9/h3-5H,13H2,1-2H3.
What are the key properties of 3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine?
3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine has a molecular weight of 206.22 g/mol, XLogP of 2.68, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 117294555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).