2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole

C14H6ClF4N3O — CID 15957161

IUPAC2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole
SMILESFc1ccccc1-c1nnc(-c2ncc(C(F)(F)F)cc2Cl)o1
InChIInChI=1S/C14H6ClF4N3O/c15-9-5-7(14(17,18)19)6-20-11(9)13-22-21-12(23-13)8-3-1-2-4-10(8)16/h1-6H
InChIKeyZVTIQNFXBGLGLS-UHFFFAOYSA-N
MW343.67 g/mol
LogP4.61
Rot. Bonds2

About 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole

2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole (PubChem CID 15957161) has the molecular formula C14H6ClF4N3O and a molecular weight of 343.67 g/mol. Its IUPAC name is 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole
PubChem CID15957161
Molecular FormulaC14H6ClF4N3O
Molecular Weight343.67 g/mol
Exact Mass343.01
IUPAC Name2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole
SMILESFc1ccccc1-c1nnc(-c2ncc(C(F)(F)F)cc2Cl)o1
InChIInChI=1S/C14H6ClF4N3O/c15-9-5-7(14(17,18)19)6-20-11(9)13-22-21-12(23-13)8-3-1-2-4-10(8)16/h1-6H
InChIKeyZVTIQNFXBGLGLS-UHFFFAOYSA-N
XLogP4.61
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.67
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole 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-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole?
The IUPAC name of 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole (CID 15957161) is 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole?
The canonical SMILES for 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole is Fc1ccccc1-c1nnc(-c2ncc(C(F)(F)F)cc2Cl)o1.
What is the InChIKey of 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole?
The InChIKey is ZVTIQNFXBGLGLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H6ClF4N3O/c15-9-5-7(14(17,18)19)6-20-11(9)13-22-21-12(23-13)8-3-1-2-4-10(8)16/h1-6H.
What are the key properties of 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole?
2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole has a molecular weight of 343.67 g/mol, XLogP of 4.61, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole is sourced from PubChem (CID 15957161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).