4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole

C15H9F3N2O — CID 162418221

IUPAC4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole
SMILESFC(F)(F)c1ccc(-c2nc(-c3ccccc3)co2)cn1
InChIInChI=1S/C15H9F3N2O/c16-15(17,18)13-7-6-11(8-19-13)14-20-12(9-21-14)10-4-2-1-3-5-10/h1-9H
InChIKeySOCSCSZNMRTLKV-UHFFFAOYSA-N
MW290.24 g/mol
LogP4.42
Rot. Bonds2

About 4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole

4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole (PubChem CID 162418221) has the molecular formula C15H9F3N2O and a molecular weight of 290.24 g/mol. Its IUPAC name is 4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole.

Molecular Properties

Compound Name4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole
PubChem CID162418221
Molecular FormulaC15H9F3N2O
Molecular Weight290.24 g/mol
Exact Mass290.07
IUPAC Name4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole
SMILESFC(F)(F)c1ccc(-c2nc(-c3ccccc3)co2)cn1
InChIInChI=1S/C15H9F3N2O/c16-15(17,18)13-7-6-11(8-19-13)14-20-12(9-21-14)10-4-2-1-3-5-10/h1-9H
InChIKeySOCSCSZNMRTLKV-UHFFFAOYSA-N
XLogP4.42
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.24
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole?
The IUPAC name of 4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole (CID 162418221) is 4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole.
What is the SMILES notation for 4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole?
The canonical SMILES for 4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole is FC(F)(F)c1ccc(-c2nc(-c3ccccc3)co2)cn1.
What is the InChIKey of 4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole?
The InChIKey is SOCSCSZNMRTLKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F3N2O/c16-15(17,18)13-7-6-11(8-19-13)14-20-12(9-21-14)10-4-2-1-3-5-10/h1-9H.
What are the key properties of 4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole?
4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole has a molecular weight of 290.24 g/mol, XLogP of 4.42, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-oxazole is sourced from PubChem (CID 162418221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).