5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol

C17H15NO3 — CID 658549

IUPAC5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol
SMILESCOc1ccc(-c2onc(C)c2-c2ccccc2)c(O)c1
InChIInChI=1S/C17H15NO3/c1-11-16(12-6-4-3-5-7-12)17(21-18-11)14-9-8-13(20-2)10-15(14)19/h3-10,19H,1-2H3
InChIKeyGTTFDPGSBZBOPZ-UHFFFAOYSA-N
MW281.31 g/mol
LogP4.03
Rot. Bonds3

About 5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol

5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol (PubChem CID 658549) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is 5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol.

Molecular Properties

Compound Name5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol
PubChem CID658549
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC Name5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol
SMILESCOc1ccc(-c2onc(C)c2-c2ccccc2)c(O)c1
InChIInChI=1S/C17H15NO3/c1-11-16(12-6-4-3-5-7-12)17(21-18-11)14-9-8-13(20-2)10-15(14)19/h3-10,19H,1-2H3
InChIKeyGTTFDPGSBZBOPZ-UHFFFAOYSA-N
XLogP4.03
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol?
The IUPAC name of 5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol (CID 658549) is 5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol.
What is the SMILES notation for 5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol?
The canonical SMILES for 5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol is COc1ccc(-c2onc(C)c2-c2ccccc2)c(O)c1.
What is the InChIKey of 5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol?
The InChIKey is GTTFDPGSBZBOPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3/c1-11-16(12-6-4-3-5-7-12)17(21-18-11)14-9-8-13(20-2)10-15(14)19/h3-10,19H,1-2H3.
What are the key properties of 5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol?
5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol has a molecular weight of 281.31 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol is sourced from PubChem (CID 658549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).