N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

C21H15N3O2 — CID 2231948

IUPACN-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
SMILESO=C(Nc1ccccc1)c1cccc(-c2nnc(-c3ccccc3)o2)c1
InChIInChI=1S/C21H15N3O2/c25-19(22-18-12-5-2-6-13-18)16-10-7-11-17(14-16)21-24-23-20(26-21)15-8-3-1-4-9-15/h1-14H,(H,22,25)
InChIKeyRIHOYVMBUVLYNC-UHFFFAOYSA-N
MW341.37 g/mol
LogP4.66
Rot. Bonds4

About N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide (PubChem CID 2231948) has the molecular formula C21H15N3O2 and a molecular weight of 341.37 g/mol. Its IUPAC name is N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide.

Molecular Properties

Compound NameN-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
PubChem CID2231948
Molecular FormulaC21H15N3O2
Molecular Weight341.37 g/mol
Exact Mass341.12
IUPAC NameN-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
SMILESO=C(Nc1ccccc1)c1cccc(-c2nnc(-c3ccccc3)o2)c1
InChIInChI=1S/C21H15N3O2/c25-19(22-18-12-5-2-6-13-18)16-10-7-11-17(14-16)21-24-23-20(26-21)15-8-3-1-4-9-15/h1-14H,(H,22,25)
InChIKeyRIHOYVMBUVLYNC-UHFFFAOYSA-N
XLogP4.66
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
The IUPAC name of N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide (CID 2231948) is N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide.
What is the SMILES notation for N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
The canonical SMILES for N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide is O=C(Nc1ccccc1)c1cccc(-c2nnc(-c3ccccc3)o2)c1.
What is the InChIKey of N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
The InChIKey is RIHOYVMBUVLYNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15N3O2/c25-19(22-18-12-5-2-6-13-18)16-10-7-11-17(14-16)21-24-23-20(26-21)15-8-3-1-4-9-15/h1-14H,(H,22,25).
What are the key properties of N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide has a molecular weight of 341.37 g/mol, XLogP of 4.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide is sourced from PubChem (CID 2231948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).