oxadiazole;N-phenylacetamide

C10H11N3O2 — CID 174471182

IUPACoxadiazole;N-phenylacetamide
SMILESCC(=O)Nc1ccccc1.c1conn1
InChIInChI=1S/C8H9NO.C2H2N2O/c1-7(10)9-8-5-3-2-4-6-8;1-2-5-4-3-1/h2-6H,1H3,(H,9,10);1-2H
InChIKeyMZQHWJRWRJPUDK-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.71
Rot. Bonds1

About oxadiazole;N-phenylacetamide

oxadiazole;N-phenylacetamide (PubChem CID 174471182) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is oxadiazole;N-phenylacetamide.

Molecular Properties

Compound Nameoxadiazole;N-phenylacetamide
PubChem CID174471182
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Nameoxadiazole;N-phenylacetamide
SMILESCC(=O)Nc1ccccc1.c1conn1
InChIInChI=1S/C8H9NO.C2H2N2O/c1-7(10)9-8-5-3-2-4-6-8;1-2-5-4-3-1/h2-6H,1H3,(H,9,10);1-2H
InChIKeyMZQHWJRWRJPUDK-UHFFFAOYSA-N
XLogP1.71
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of oxadiazole;N-phenylacetamide?
The IUPAC name of oxadiazole;N-phenylacetamide (CID 174471182) is oxadiazole;N-phenylacetamide.
What is the SMILES notation for oxadiazole;N-phenylacetamide?
The canonical SMILES for oxadiazole;N-phenylacetamide is CC(=O)Nc1ccccc1.c1conn1.
What is the InChIKey of oxadiazole;N-phenylacetamide?
The InChIKey is MZQHWJRWRJPUDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO.C2H2N2O/c1-7(10)9-8-5-3-2-4-6-8;1-2-5-4-3-1/h2-6H,1H3,(H,9,10);1-2H.
What are the key properties of oxadiazole;N-phenylacetamide?
oxadiazole;N-phenylacetamide has a molecular weight of 205.22 g/mol, XLogP of 1.71, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxadiazole;N-phenylacetamide is sourced from PubChem (CID 174471182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).