N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide

C15H9F2N3O2 — CID 43972074

IUPACN-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide
SMILESO=C(Nc1nnc(-c2ccc(F)cc2F)o1)c1ccccc1
InChIInChI=1S/C15H9F2N3O2/c16-10-6-7-11(12(17)8-10)14-19-20-15(22-14)18-13(21)9-4-2-1-3-5-9/h1-8H,(H,18,20,21)
InChIKeyKDRCBNIJPFTJBS-UHFFFAOYSA-N
MW301.25 g/mol
LogP3.27
Rot. Bonds3

About N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide

N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide (PubChem CID 43972074) has the molecular formula C15H9F2N3O2 and a molecular weight of 301.25 g/mol. Its IUPAC name is N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide.

Molecular Properties

Compound NameN-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide
PubChem CID43972074
Molecular FormulaC15H9F2N3O2
Molecular Weight301.25 g/mol
Exact Mass301.07
IUPAC NameN-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide
SMILESO=C(Nc1nnc(-c2ccc(F)cc2F)o1)c1ccccc1
InChIInChI=1S/C15H9F2N3O2/c16-10-6-7-11(12(17)8-10)14-19-20-15(22-14)18-13(21)9-4-2-1-3-5-9/h1-8H,(H,18,20,21)
InChIKeyKDRCBNIJPFTJBS-UHFFFAOYSA-N
XLogP3.27
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.25
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-4-methylbenzamide
CID 43972075
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-3,5-dinitrobenzamide
CID 43972170
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]furan-2-carboxamide
CID 43972032
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide
CID 43972132
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-3-phenylpropanamide
CID 43972157
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-3-methoxynaphthalene-2-carboxamide
CID 43972172
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(4-fluorophenyl)acetamide
CID 43972042
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-4-morpholin-4-ylsulfonylbenzamide
CID 43972096
N-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]-4-(pentafluoro-λ6-sulfanyl)benzamide
CID 164839624
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methoxyphenoxy)acetamide
CID 43972062
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-1-propan-2-ylpyrazole-3-carboxamide
CID 43972269
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-1-ethylpyrazole-3-carboxamide
CID 43972265

Frequently Asked Questions

What is the IUPAC name of N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide?
The IUPAC name of N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide (CID 43972074) is N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide.
What is the SMILES notation for N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide?
The canonical SMILES for N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide is O=C(Nc1nnc(-c2ccc(F)cc2F)o1)c1ccccc1.
What is the InChIKey of N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide?
The InChIKey is KDRCBNIJPFTJBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F2N3O2/c16-10-6-7-11(12(17)8-10)14-19-20-15(22-14)18-13(21)9-4-2-1-3-5-9/h1-8H,(H,18,20,21).
What are the key properties of N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide?
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide has a molecular weight of 301.25 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide is sourced from PubChem (CID 43972074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).