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

C16H13N3O2 — CID 4896210

IUPACN-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2nc(-c3ccccc3)no2)c1
InChIInChI=1S/C16H13N3O2/c1-11(20)17-14-9-5-8-13(10-14)16-18-15(19-21-16)12-6-3-2-4-7-12/h2-10H,1H3,(H,17,20)
InChIKeyICNSPKSHORURHU-UHFFFAOYSA-N
MW279.30 g/mol
LogP3.36
Rot. Bonds3

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

N-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide (PubChem CID 4896210) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is N-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide
PubChem CID4896210
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC NameN-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2nc(-c3ccccc3)no2)c1
InChIInChI=1S/C16H13N3O2/c1-11(20)17-14-9-5-8-13(10-14)16-18-15(19-21-16)12-6-3-2-4-7-12/h2-10H,1H3,(H,17,20)
InChIKeyICNSPKSHORURHU-UHFFFAOYSA-N
XLogP3.36
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide?
The IUPAC name of N-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide (CID 4896210) is N-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide.
What is the SMILES notation for N-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide?
The canonical SMILES for N-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide is CC(=O)Nc1cccc(-c2nc(-c3ccccc3)no2)c1.
What is the InChIKey of N-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide?
The InChIKey is ICNSPKSHORURHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c1-11(20)17-14-9-5-8-13(10-14)16-18-15(19-21-16)12-6-3-2-4-7-12/h2-10H,1H3,(H,17,20).
What are the key properties of N-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide?
N-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide has a molecular weight of 279.30 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]acetamide is sourced from PubChem (CID 4896210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).