5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole

C16H10FN3O — CID 162643919

IUPAC5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole
SMILESFc1ccc(-c2nc(-c3ccc4[nH]ccc4c3)no2)cc1
InChIInChI=1S/C16H10FN3O/c17-13-4-1-10(2-5-13)16-19-15(20-21-16)12-3-6-14-11(9-12)7-8-18-14/h1-9,18H
InChIKeyRBFZMBTWOKIIPS-UHFFFAOYSA-N
MW279.27 g/mol
LogP4.02
Rot. Bonds2

About 5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole

5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole (PubChem CID 162643919) has the molecular formula C16H10FN3O and a molecular weight of 279.27 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole
PubChem CID162643919
Molecular FormulaC16H10FN3O
Molecular Weight279.27 g/mol
Exact Mass279.08
IUPAC Name5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole
SMILESFc1ccc(-c2nc(-c3ccc4[nH]ccc4c3)no2)cc1
InChIInChI=1S/C16H10FN3O/c17-13-4-1-10(2-5-13)16-19-15(20-21-16)12-3-6-14-11(9-12)7-8-18-14/h1-9,18H
InChIKeyRBFZMBTWOKIIPS-UHFFFAOYSA-N
XLogP4.02
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.27
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1H-indol-5-yl)-5-(4-methylsulfanylphenyl)-1,2,4-oxadiazole
CID 162651749
5-(1H-indol-5-yl)-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,2,4-oxadiazole
CID 139308391
3-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoic acid
CID 11818444
5-fluoro-1H-indole;molecular fluorine
CID 123133815
5-(2,4-difluorophenyl)-1H-indole
CID 10176960
[3-(1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]-piperidin-1-ylmethanone
CID 42568916
5-(1H-indol-5-yl)-3-[(3R)-oxolan-3-yl]-1,2,4-oxadiazole
CID 97455316
[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-(1H-indol-5-yl)methanone
CID 11257794
5-[4-(difluoromethoxy)-3-methoxyphenyl]-3-(4-fluorophenyl)-1,2,4-oxadiazole
CID 19326293
6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole
CID 142734680
5-fluoro-2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]phenol
CID 136809721
5-(5-bromofuran-2-yl)-3-(4-fluorophenyl)-1,2,4-oxadiazole
CID 6458361

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole?
The IUPAC name of 5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole (CID 162643919) is 5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole.
What is the SMILES notation for 5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole?
The canonical SMILES for 5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole is Fc1ccc(-c2nc(-c3ccc4[nH]ccc4c3)no2)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole?
The InChIKey is RBFZMBTWOKIIPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FN3O/c17-13-4-1-10(2-5-13)16-19-15(20-21-16)12-3-6-14-11(9-12)7-8-18-14/h1-9,18H.
What are the key properties of 5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole?
5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole has a molecular weight of 279.27 g/mol, XLogP of 4.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-3-(1H-indol-5-yl)-1,2,4-oxadiazole is sourced from PubChem (CID 162643919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).