2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole

C15H9ClFNO — CID 101479658

IUPAC2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole
SMILESFc1ccc(-c2cnc(-c3ccc(Cl)cc3)o2)cc1
InChIInChI=1S/C15H9ClFNO/c16-12-5-1-11(2-6-12)15-18-9-14(19-15)10-3-7-13(17)8-4-10/h1-9H
InChIKeyIVWWHQIEVGEZSG-UHFFFAOYSA-N
MW273.69 g/mol
LogP4.80
Rot. Bonds2

About 2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole

2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole (PubChem CID 101479658) has the molecular formula C15H9ClFNO and a molecular weight of 273.69 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole.

Molecular Properties

Compound Name2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole
PubChem CID101479658
Molecular FormulaC15H9ClFNO
Molecular Weight273.69 g/mol
Exact Mass273.04
IUPAC Name2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole
SMILESFc1ccc(-c2cnc(-c3ccc(Cl)cc3)o2)cc1
InChIInChI=1S/C15H9ClFNO/c16-12-5-1-11(2-6-12)15-18-9-14(19-15)10-3-7-13(17)8-4-10/h1-9H
InChIKeyIVWWHQIEVGEZSG-UHFFFAOYSA-N
XLogP4.80
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.69
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole?
The IUPAC name of 2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole (CID 101479658) is 2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole.
What is the SMILES notation for 2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole?
The canonical SMILES for 2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole is Fc1ccc(-c2cnc(-c3ccc(Cl)cc3)o2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole?
The InChIKey is IVWWHQIEVGEZSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClFNO/c16-12-5-1-11(2-6-12)15-18-9-14(19-15)10-3-7-13(17)8-4-10/h1-9H.
What are the key properties of 2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole?
2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole has a molecular weight of 273.69 g/mol, XLogP of 4.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,3-oxazole is sourced from PubChem (CID 101479658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).