N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide

C14H9FN4O2 — CID 22520978

IUPACN-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide
SMILESO=C(Nc1ccc(F)cc1)c1nc(-c2ccncc2)no1
InChIInChI=1S/C14H9FN4O2/c15-10-1-3-11(4-2-10)17-13(20)14-18-12(19-21-14)9-5-7-16-8-6-9/h1-8H,(H,17,20)
InChIKeyXBGHMZGQBWGYST-UHFFFAOYSA-N
MW284.25 g/mol
LogP2.52
Rot. Bonds3

About N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide

N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide (PubChem CID 22520978) has the molecular formula C14H9FN4O2 and a molecular weight of 284.25 g/mol. Its IUPAC name is N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide
PubChem CID22520978
Molecular FormulaC14H9FN4O2
Molecular Weight284.25 g/mol
Exact Mass284.07
IUPAC NameN-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide
SMILESO=C(Nc1ccc(F)cc1)c1nc(-c2ccncc2)no1
InChIInChI=1S/C14H9FN4O2/c15-10-1-3-11(4-2-10)17-13(20)14-18-12(19-21-14)9-5-7-16-8-6-9/h1-8H,(H,17,20)
InChIKeyXBGHMZGQBWGYST-UHFFFAOYSA-N
XLogP2.52
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.25
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-chlorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide
CID 22520979
[4-(5-pyridin-4-yl-1,2,4-oxadiazol-3-yl)phenyl]carbamic acid
CID 21483705
4-(4-fluorophenyl)-N-pyridin-4-ylbenzamide
CID 135137810
N-[4-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenyl]thiophene-2-carboxamide
CID 2203267
2-fluoro-N-[4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]phenyl]benzamide
CID 39867075
3-(4-fluorophenyl)-N-[(2R)-2-hydroxypropyl]-1,2,4-oxadiazole-5-carboxamide
CID 42534811
N-(4-fluorophenyl)-2-[6-oxo-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)-4,5-dihydropyridazin-1-yl]acetamide
CID 53157196
3-(4-fluorophenyl)-N-[2-[(4-methylbenzoyl)amino]ethyl]-1,2,4-oxadiazole-5-carboxamide
CID 17083881
N-(4-fluorophenyl)-2-[[4-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-thiazol-2-yl]sulfanyl]acetamide
CID 90603755
N-[4-(5-benzyl-1,2,4-oxadiazol-3-yl)phenyl]-4-fluorobenzamide
CID 17052840
3-pyridin-4-yl-N-(pyridin-2-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
CID 22521001
3-phenyl-N-(pyridin-4-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
CID 6472637

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide (CID 22520978) is N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide is O=C(Nc1ccc(F)cc1)c1nc(-c2ccncc2)no1.
What is the InChIKey of N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide?
The InChIKey is XBGHMZGQBWGYST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FN4O2/c15-10-1-3-11(4-2-10)17-13(20)14-18-12(19-21-14)9-5-7-16-8-6-9/h1-8H,(H,17,20).
What are the key properties of N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide?
N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide has a molecular weight of 284.25 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxamide is sourced from PubChem (CID 22520978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).