5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole

C16H12FNO — CID 11687481

IUPAC5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole
SMILESCc1nc(-c2ccccc2)oc1-c1ccc(F)cc1
InChIInChI=1S/C16H12FNO/c1-11-15(12-7-9-14(17)10-8-12)19-16(18-11)13-5-3-2-4-6-13/h2-10H,1H3
InChIKeyOHTFHYXMXVEHGX-UHFFFAOYSA-N
MW253.28 g/mol
LogP4.46
Rot. Bonds2

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

5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole (PubChem CID 11687481) has the molecular formula C16H12FNO and a molecular weight of 253.28 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole.

Molecular Properties

Compound Name5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole
PubChem CID11687481
Molecular FormulaC16H12FNO
Molecular Weight253.28 g/mol
Exact Mass253.09
IUPAC Name5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole
SMILESCc1nc(-c2ccccc2)oc1-c1ccc(F)cc1
InChIInChI=1S/C16H12FNO/c1-11-15(12-7-9-14(17)10-8-12)19-16(18-11)13-5-3-2-4-6-13/h2-10H,1H3
InChIKeyOHTFHYXMXVEHGX-UHFFFAOYSA-N
XLogP4.46
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.28
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole?
The IUPAC name of 5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole (CID 11687481) is 5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole.
What is the SMILES notation for 5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole?
The canonical SMILES for 5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole is Cc1nc(-c2ccccc2)oc1-c1ccc(F)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole?
The InChIKey is OHTFHYXMXVEHGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNO/c1-11-15(12-7-9-14(17)10-8-12)19-16(18-11)13-5-3-2-4-6-13/h2-10H,1H3.
What are the key properties of 5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole?
5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole has a molecular weight of 253.28 g/mol, XLogP of 4.46, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole is sourced from PubChem (CID 11687481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).