5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole

C11H10FNO2 — CID 116868898

IUPAC5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole
SMILESCOc1ccc(F)cc1-c1cc(C)no1
InChIInChI=1S/C11H10FNO2/c1-7-5-11(15-13-7)9-6-8(12)3-4-10(9)14-2/h3-6H,1-2H3
InChIKeyKXWGPKGCYRXFAK-UHFFFAOYSA-N
MW207.20 g/mol
LogP2.80
Rot. Bonds2

About 5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole

5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole (PubChem CID 116868898) has the molecular formula C11H10FNO2 and a molecular weight of 207.20 g/mol. Its IUPAC name is 5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole.

Molecular Properties

Compound Name5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole
PubChem CID116868898
Molecular FormulaC11H10FNO2
Molecular Weight207.20 g/mol
Exact Mass207.07
IUPAC Name5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole
SMILESCOc1ccc(F)cc1-c1cc(C)no1
InChIInChI=1S/C11H10FNO2/c1-7-5-11(15-13-7)9-6-8(12)3-4-10(9)14-2/h3-6H,1-2H3
InChIKeyKXWGPKGCYRXFAK-UHFFFAOYSA-N
XLogP2.80
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.20
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(5-fluoro-2-methoxyphenyl)-1,2-oxazol-3-yl]methanamine
CID 82472973
5-(2,5-difluorophenyl)-3-methyl-1,2-oxazole
CID 116868922
1-[5-(5-fluoro-2-methoxyphenyl)-1,2-oxazol-3-yl]ethanone
CID 82129338
5-(2,4-difluorophenyl)-3-methyl-1,2-oxazole
CID 116868938
4-(5-fluoro-2-methoxyphenyl)-2-(4-methylphenyl)-1,3-thiazole
CID 8963152
N-(4-fluoro-2-methylphenyl)-2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamide
CID 20935107
5-(4-fluoro-2-methoxyphenyl)-1,2-oxazole-3-carboxylic acid
CID 117345967
5-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-3-methyl-1,2-oxazole
CID 116868925
4-(5-fluoro-2-methoxyphenyl)-6-methylpyrimidin-5-amine
CID 82390103
3-(5-fluoro-2-methoxyphenyl)-1-methyl-1,2,4-triazole
CID 166492561
3-ethyl-4-(5-fluoro-2-methoxyphenyl)-1,2-oxazol-5-amine
CID 82083559
5-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3-methyl-1,2-oxazole
CID 122146031

Frequently Asked Questions

What is the IUPAC name of 5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole?
The IUPAC name of 5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole (CID 116868898) is 5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole.
What is the SMILES notation for 5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole?
The canonical SMILES for 5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole is COc1ccc(F)cc1-c1cc(C)no1.
What is the InChIKey of 5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole?
The InChIKey is KXWGPKGCYRXFAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNO2/c1-7-5-11(15-13-7)9-6-8(12)3-4-10(9)14-2/h3-6H,1-2H3.
What are the key properties of 5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole?
5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole has a molecular weight of 207.20 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-fluoro-2-methoxyphenyl)-3-methyl-1,2-oxazole is sourced from PubChem (CID 116868898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).