N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide

C23H19N3O3 — CID 20939884

IUPACN-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide
SMILESO=C(COc1ccccc1-c1nnc(-c2ccccc2)o1)NCc1ccccc1
InChIInChI=1S/C23H19N3O3/c27-21(24-15-17-9-3-1-4-10-17)16-28-20-14-8-7-13-19(20)23-26-25-22(29-23)18-11-5-2-6-12-18/h1-14H,15-16H2,(H,24,27)
InChIKeyACVKHABLHJKJMK-UHFFFAOYSA-N
MW385.42 g/mol
LogP4.10
Rot. Bonds7

About N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide

N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide (PubChem CID 20939884) has the molecular formula C23H19N3O3 and a molecular weight of 385.42 g/mol. Its IUPAC name is N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide.

Molecular Properties

Compound NameN-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide
PubChem CID20939884
Molecular FormulaC23H19N3O3
Molecular Weight385.42 g/mol
Exact Mass385.14
IUPAC NameN-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide
SMILESO=C(COc1ccccc1-c1nnc(-c2ccccc2)o1)NCc1ccccc1
InChIInChI=1S/C23H19N3O3/c27-21(24-15-17-9-3-1-4-10-17)16-28-20-14-8-7-13-19(20)23-26-25-22(29-23)18-11-5-2-6-12-18/h1-14H,15-16H2,(H,24,27)
InChIKeyACVKHABLHJKJMK-UHFFFAOYSA-N
XLogP4.10
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The IUPAC name of N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide (CID 20939884) is N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide.
What is the SMILES notation for N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The canonical SMILES for N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide is O=C(COc1ccccc1-c1nnc(-c2ccccc2)o1)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The InChIKey is ACVKHABLHJKJMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O3/c27-21(24-15-17-9-3-1-4-10-17)16-28-20-14-8-7-13-19(20)23-26-25-22(29-23)18-11-5-2-6-12-18/h1-14H,15-16H2,(H,24,27).
What are the key properties of N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide has a molecular weight of 385.42 g/mol, XLogP of 4.10, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide is sourced from PubChem (CID 20939884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).