[3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol

C20H14FN3O2 — CID 56900952

IUPAC[3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol
SMILESOCc1cccc(-c2ccc(-c3nc(-c4ccccc4F)no3)cn2)c1
InChIInChI=1S/C20H14FN3O2/c21-17-7-2-1-6-16(17)19-23-20(26-24-19)15-8-9-18(22-11-15)14-5-3-4-13(10-14)12-25/h1-11,25H,12H2
InChIKeyPQSITDFUBJRQEV-UHFFFAOYSA-N
MW347.35 g/mol
LogP4.10
Rot. Bonds4

About [3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol

[3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol (PubChem CID 56900952) has the molecular formula C20H14FN3O2 and a molecular weight of 347.35 g/mol. Its IUPAC name is [3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol.

Molecular Properties

Compound Name[3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol
PubChem CID56900952
Molecular FormulaC20H14FN3O2
Molecular Weight347.35 g/mol
Exact Mass347.11
IUPAC Name[3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol
SMILESOCc1cccc(-c2ccc(-c3nc(-c4ccccc4F)no3)cn2)c1
InChIInChI=1S/C20H14FN3O2/c21-17-7-2-1-6-16(17)19-23-20(26-24-19)15-8-9-18(22-11-15)14-5-3-4-13(10-14)12-25/h1-11,25H,12H2
InChIKeyPQSITDFUBJRQEV-UHFFFAOYSA-N
XLogP4.10
TPSA72.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.35
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-Naphthalen-1-yl-3-pyridin-2-yl-1,2,4-oxadiazole
CID 757874
3-(2-Pyridyl)-5-(3-fluorophenyl)-1,2,4-oxadiazole
CID 6463470
2-(5-Biphenyl-4-yl-[1,2,4]oxadiazol-3-yl)-pyridine
CID 838877
3-Phenyl-5-(3-pyridyl)-1,2,4-oxadiazole
CID 1122276
3-(Pyridin-2-yl)-5-(3-methylphenyl)-1,2,4-oxadiazole
CID 3156022
5-(2-Phenylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole
CID 976211
5-Naphthalen-1-yl-3-pyridin-3-yl-1,2,4-oxadiazole
CID 1946433
3-(4-(5-(6-Isobutylpyridin-3-yl)-1,2,4-oxadiazol-3-yl)-3-methylphenyl)propanoic acid
CID 44412702
[1-[5-[3-(2-Fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-2-yl]methanol
CID 45226955
2-[4-(5-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-YL}pyridin-2-YL)piperazin-1-YL]ethanol
CID 70724909
5-(3,4-Difluorophenyl)-3-(6-methylpyridin-3-yl)-1,2,4-oxadiazole
CID 145989809
5-[4-Phenyl-3-(trifluoromethyl)phenyl]-3-pyridin-3-yl-1,2,4-oxadiazole
CID 25110234

Frequently Asked Questions

What is the IUPAC name of [3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol?
The IUPAC name of [3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol (CID 56900952) is [3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol.
What is the SMILES notation for [3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol?
The canonical SMILES for [3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol is OCc1cccc(-c2ccc(-c3nc(-c4ccccc4F)no3)cn2)c1.
What is the InChIKey of [3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol?
The InChIKey is PQSITDFUBJRQEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14FN3O2/c21-17-7-2-1-6-16(17)19-23-20(26-24-19)15-8-9-18(22-11-15)14-5-3-4-13(10-14)12-25/h1-11,25H,12H2.
What are the key properties of [3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol?
[3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol has a molecular weight of 347.35 g/mol, XLogP of 4.10, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]phenyl]methanol is sourced from PubChem (CID 56900952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).