2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol

C12H11NO2 — CID 840164

IUPAC2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol
SMILESCc1cc(C=Cc2ccccc2O)on1
InChIInChI=1S/C12H11NO2/c1-9-8-11(15-13-9)7-6-10-4-2-3-5-12(10)14/h2-8,14H,1H3
InChIKeyRLTXUAYQASJWBP-UHFFFAOYSA-N
MW201.22 g/mol
LogP2.86
Rot. Bonds2

About 2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol

2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol (PubChem CID 840164) has the molecular formula C12H11NO2 and a molecular weight of 201.22 g/mol. Its IUPAC name is 2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol.

Molecular Properties

Compound Name2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol
PubChem CID840164
Molecular FormulaC12H11NO2
Molecular Weight201.22 g/mol
Exact Mass201.08
IUPAC Name2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol
SMILESCc1cc(C=Cc2ccccc2O)on1
InChIInChI=1S/C12H11NO2/c1-9-8-11(15-13-9)7-6-10-4-2-3-5-12(10)14/h2-8,14H,1H3
InChIKeyRLTXUAYQASJWBP-UHFFFAOYSA-N
XLogP2.86
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol?
The IUPAC name of 2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol (CID 840164) is 2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol.
What is the SMILES notation for 2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol?
The canonical SMILES for 2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol is Cc1cc(C=Cc2ccccc2O)on1.
What is the InChIKey of 2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol?
The InChIKey is RLTXUAYQASJWBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2/c1-9-8-11(15-13-9)7-6-10-4-2-3-5-12(10)14/h2-8,14H,1H3.
What are the key properties of 2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol?
2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol has a molecular weight of 201.22 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenol is sourced from PubChem (CID 840164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).