2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole

C13H15NO — CID 118351565

IUPAC2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole
SMILESC=C1OC(c2cc(C)ccc2C)=NC1C
InChIInChI=1S/C13H15NO/c1-8-5-6-9(2)12(7-8)13-14-10(3)11(4)15-13/h5-7,10H,4H2,1-3H3
InChIKeyAPFDCZUUJMXHSI-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.98
Rot. Bonds1

About 2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole

2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole (PubChem CID 118351565) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole
PubChem CID118351565
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole
SMILESC=C1OC(c2cc(C)ccc2C)=NC1C
InChIInChI=1S/C13H15NO/c1-8-5-6-9(2)12(7-8)13-14-10(3)11(4)15-13/h5-7,10H,4H2,1-3H3
InChIKeyAPFDCZUUJMXHSI-UHFFFAOYSA-N
XLogP2.98
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2,5-dimethylphenyl)-3-methyl-1,2-oxazole
CID 116868891
2,5-dimethyl-3-methylidene-1-benzofuran
CID 126604553
5-(2,5-dimethylphenyl)-1,3,4-thiadiazol-2-amine
CID 14091156
2-(2,5-dimethylphenyl)-4,5-dimethylpyridine
CID 166896824
3-(2,5-dimethylphenyl)-5-methyl-1H-pyrazole
CID 82111649
1-(2,5-dimethylphenyl)-2-fluoro-4-methylbenzene
CID 138652236
5-(2,5-dimethylphenyl)-2,6-dimethylpyrimidin-4-amine
CID 82288023
[2-(2,5-dimethylphenyl)pyrimidin-4-yl]phosphane
CID 143060384
5-(2,5-dimethylphenyl)-3-methylbenzene-1,2,4-triol
CID 101299521
(2S)-2,5-dimethyl-3-methylidene-1,2-dihydroindene
CID 145271864
2-(2,5-dimethylphenyl)-4-methyl-1,3-thiazole
CID 116891864
1,2,4-trimethylbenzene
CID 7247

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole?
The IUPAC name of 2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole (CID 118351565) is 2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole?
The canonical SMILES for 2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole is C=C1OC(c2cc(C)ccc2C)=NC1C.
What is the InChIKey of 2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole?
The InChIKey is APFDCZUUJMXHSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-8-5-6-9(2)12(7-8)13-14-10(3)11(4)15-13/h5-7,10H,4H2,1-3H3.
What are the key properties of 2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole?
2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole has a molecular weight of 201.27 g/mol, XLogP of 2.98, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-4-methyl-5-methylidene-4H-1,3-oxazole is sourced from PubChem (CID 118351565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).