2,5-bis(4-methoxyphenyl)-1,3-oxazole

C17H15NO3 — CID 13404049

IUPAC2,5-bis(4-methoxyphenyl)-1,3-oxazole
SMILESCOc1ccc(-c2cnc(-c3ccc(OC)cc3)o2)cc1
InChIInChI=1S/C17H15NO3/c1-19-14-7-3-12(4-8-14)16-11-18-17(21-16)13-5-9-15(20-2)10-6-13/h3-11H,1-2H3
InChIKeyNHNMUPTZVKPGEZ-UHFFFAOYSA-N
MW281.31 g/mol
LogP4.03
Rot. Bonds4

About 2,5-bis(4-methoxyphenyl)-1,3-oxazole

2,5-bis(4-methoxyphenyl)-1,3-oxazole (PubChem CID 13404049) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is 2,5-bis(4-methoxyphenyl)-1,3-oxazole.

Molecular Properties

Compound Name2,5-bis(4-methoxyphenyl)-1,3-oxazole
PubChem CID13404049
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC Name2,5-bis(4-methoxyphenyl)-1,3-oxazole
SMILESCOc1ccc(-c2cnc(-c3ccc(OC)cc3)o2)cc1
InChIInChI=1S/C17H15NO3/c1-19-14-7-3-12(4-8-14)16-11-18-17(21-16)13-5-9-15(20-2)10-6-13/h3-11H,1-2H3
InChIKeyNHNMUPTZVKPGEZ-UHFFFAOYSA-N
XLogP4.03
TPSA44.49 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2,5-bis(4-methoxyphenyl)-1,3-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,5-bis(4-methoxyphenyl)-1,3-oxazole?
The IUPAC name of 2,5-bis(4-methoxyphenyl)-1,3-oxazole (CID 13404049) is 2,5-bis(4-methoxyphenyl)-1,3-oxazole.
What is the SMILES notation for 2,5-bis(4-methoxyphenyl)-1,3-oxazole?
The canonical SMILES for 2,5-bis(4-methoxyphenyl)-1,3-oxazole is COc1ccc(-c2cnc(-c3ccc(OC)cc3)o2)cc1.
What is the InChIKey of 2,5-bis(4-methoxyphenyl)-1,3-oxazole?
The InChIKey is NHNMUPTZVKPGEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3/c1-19-14-7-3-12(4-8-14)16-11-18-17(21-16)13-5-9-15(20-2)10-6-13/h3-11H,1-2H3.
What are the key properties of 2,5-bis(4-methoxyphenyl)-1,3-oxazole?
2,5-bis(4-methoxyphenyl)-1,3-oxazole has a molecular weight of 281.31 g/mol, XLogP of 4.03, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(4-methoxyphenyl)-1,3-oxazole is sourced from PubChem (CID 13404049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).