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

C11H11NO2 — CID 67394978

IUPAC5-(3-methoxyphenyl)-2-methyl-1,3-oxazole
SMILESCOc1cccc(-c2cnc(C)o2)c1
InChIInChI=1S/C11H11NO2/c1-8-12-7-11(14-8)9-4-3-5-10(6-9)13-2/h3-7H,1-2H3
InChIKeyWIRIYRZIDVVUPX-UHFFFAOYSA-N
MW189.21 g/mol
LogP2.66
Rot. Bonds2

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

5-(3-methoxyphenyl)-2-methyl-1,3-oxazole (PubChem CID 67394978) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 5-(3-methoxyphenyl)-2-methyl-1,3-oxazole.

Molecular Properties

Compound Name5-(3-methoxyphenyl)-2-methyl-1,3-oxazole
PubChem CID67394978
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name5-(3-methoxyphenyl)-2-methyl-1,3-oxazole
SMILESCOc1cccc(-c2cnc(C)o2)c1
InChIInChI=1S/C11H11NO2/c1-8-12-7-11(14-8)9-4-3-5-10(6-9)13-2/h3-7H,1-2H3
InChIKeyWIRIYRZIDVVUPX-UHFFFAOYSA-N
XLogP2.66
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methoxyphenyl)-5-(4-methoxyphenyl)-1,3-oxazole
CID 58157224
3-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]propan-1-amine
CID 65179138
N-[[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]methyl]propan-2-amine
CID 65184141
5-(3-methoxyphenyl)-2,3-dimethylfuran
CID 70996763
N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
CID 65181244
2-(3-methoxyphenyl)-5-methylpyrimidine
CID 121432653
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide
CID 100500293
3-(3-methoxyphenyl)-1,2,4-oxadiazole
CID 57176807
[5-(3-methoxyphenyl)furan-2-yl]methanamine
CID 43826373
5-(3-methoxyphenyl)-3H-1,3-oxazole-2-thione
CID 18439774

Frequently Asked Questions

What is the IUPAC name of 5-(3-methoxyphenyl)-2-methyl-1,3-oxazole?
The IUPAC name of 5-(3-methoxyphenyl)-2-methyl-1,3-oxazole (CID 67394978) is 5-(3-methoxyphenyl)-2-methyl-1,3-oxazole.
What is the SMILES notation for 5-(3-methoxyphenyl)-2-methyl-1,3-oxazole?
The canonical SMILES for 5-(3-methoxyphenyl)-2-methyl-1,3-oxazole is COc1cccc(-c2cnc(C)o2)c1.
What is the InChIKey of 5-(3-methoxyphenyl)-2-methyl-1,3-oxazole?
The InChIKey is WIRIYRZIDVVUPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-8-12-7-11(14-8)9-4-3-5-10(6-9)13-2/h3-7H,1-2H3.
What are the key properties of 5-(3-methoxyphenyl)-2-methyl-1,3-oxazole?
5-(3-methoxyphenyl)-2-methyl-1,3-oxazole has a molecular weight of 189.21 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methoxyphenyl)-2-methyl-1,3-oxazole is sourced from PubChem (CID 67394978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).