5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole

C17H10FN3O2S — CID 167938082

IUPAC5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole
SMILESFc1ccccc1Oc1ccc(-c2nc(-c3cccs3)no2)cn1
InChIInChI=1S/C17H10FN3O2S/c18-12-4-1-2-5-13(12)22-15-8-7-11(10-19-15)17-20-16(21-23-17)14-6-3-9-24-14/h1-10H
InChIKeyMPUQQOZVWDNKGN-UHFFFAOYSA-N
MW339.35 g/mol
LogP4.79
Rot. Bonds4

About 5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole

5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole (PubChem CID 167938082) has the molecular formula C17H10FN3O2S and a molecular weight of 339.35 g/mol. Its IUPAC name is 5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole
PubChem CID167938082
Molecular FormulaC17H10FN3O2S
Molecular Weight339.35 g/mol
Exact Mass339.05
IUPAC Name5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole
SMILESFc1ccccc1Oc1ccc(-c2nc(-c3cccs3)no2)cn1
InChIInChI=1S/C17H10FN3O2S/c18-12-4-1-2-5-13(12)22-15-8-7-11(10-19-15)17-20-16(21-23-17)14-6-3-9-24-14/h1-10H
InChIKeyMPUQQOZVWDNKGN-UHFFFAOYSA-N
XLogP4.79
TPSA61.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.35
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-(6-ethylsulfanyl-3-pyridinyl)-3-thiophen-2-yl-1,2,4-oxadiazole
CID 167949067
5-[3-[(2,4-difluorophenoxy)methyl]phenyl]-3-thiophen-2-yl-1,2,4-oxadiazole
CID 19334502
5-(4-methoxyphenyl)-3-thiophen-2-yl-1,2,4-oxadiazole
CID 718725
3-fluoro-2-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)phenol
CID 136967849
3-[4-(4-fluorophenoxy)phenyl]-5-thiophen-2-yl-1,2,4-oxadiazole
CID 53103359
5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)benzene-1,3-diamine
CID 107811588
N-methyl-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)aniline
CID 104698799
5-[(2-bromophenoxy)methyl]-3-thiophen-2-yl-1,2,4-oxadiazole
CID 18775782
5-(4-methylpyrimidin-5-yl)-3-thiophen-2-yl-1,2,4-oxadiazole
CID 99130250
2-amino-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)phenol
CID 137004902
2-amino-5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)phenol
CID 60837408
5-[(2-chloro-4-fluorophenoxy)methyl]-3-thiophen-2-yl-1,2,4-oxadiazole
CID 9138008

Frequently Asked Questions

What is the IUPAC name of 5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole?
The IUPAC name of 5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole (CID 167938082) is 5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole.
What is the SMILES notation for 5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole?
The canonical SMILES for 5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole is Fc1ccccc1Oc1ccc(-c2nc(-c3cccs3)no2)cn1.
What is the InChIKey of 5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole?
The InChIKey is MPUQQOZVWDNKGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10FN3O2S/c18-12-4-1-2-5-13(12)22-15-8-7-11(10-19-15)17-20-16(21-23-17)14-6-3-9-24-14/h1-10H.
What are the key properties of 5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole?
5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole has a molecular weight of 339.35 g/mol, XLogP of 4.79, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(2-fluorophenoxy)-3-pyridinyl]-3-thiophen-2-yl-1,2,4-oxadiazole is sourced from PubChem (CID 167938082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).