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

C15H9Cl2N3O2 — CID 8608388

IUPACN-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide
SMILESO=C(Nc1nnc(-c2cc(Cl)ccc2Cl)o1)c1ccccc1
InChIInChI=1S/C15H9Cl2N3O2/c16-10-6-7-12(17)11(8-10)14-19-20-15(22-14)18-13(21)9-4-2-1-3-5-9/h1-8H,(H,18,20,21)
InChIKeyNZHKONODRJBAOG-UHFFFAOYSA-N
MW334.16 g/mol
LogP4.30
Rot. Bonds3

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

N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide (PubChem CID 8608388) has the molecular formula C15H9Cl2N3O2 and a molecular weight of 334.16 g/mol. Its IUPAC name is N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide.

Molecular Properties

Compound NameN-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide
PubChem CID8608388
Molecular FormulaC15H9Cl2N3O2
Molecular Weight334.16 g/mol
Exact Mass333.01
IUPAC NameN-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide
SMILESO=C(Nc1nnc(-c2cc(Cl)ccc2Cl)o1)c1ccccc1
InChIInChI=1S/C15H9Cl2N3O2/c16-10-6-7-12(17)11(8-10)14-19-20-15(22-14)18-13(21)9-4-2-1-3-5-9/h1-8H,(H,18,20,21)
InChIKeyNZHKONODRJBAOG-UHFFFAOYSA-N
XLogP4.30
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.16
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide?
The IUPAC name of N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide (CID 8608388) is N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide.
What is the SMILES notation for N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide?
The canonical SMILES for N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide is O=C(Nc1nnc(-c2cc(Cl)ccc2Cl)o1)c1ccccc1.
What is the InChIKey of N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide?
The InChIKey is NZHKONODRJBAOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2N3O2/c16-10-6-7-12(17)11(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-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide?
N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide has a molecular weight of 334.16 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]benzamide is sourced from PubChem (CID 8608388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).