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

C19H19N3O3 — CID 16854865

IUPAC2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide
SMILESCOc1ccc(CC(=O)Nc2nnc(-c3cccc(C)c3)o2)cc1C
InChIInChI=1S/C19H19N3O3/c1-12-5-4-6-15(9-12)18-21-22-19(25-18)20-17(23)11-14-7-8-16(24-3)13(2)10-14/h4-10H,11H2,1-3H3,(H,20,22,23)
InChIKeyZZDOGNVEQIBMAP-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.54
Rot. Bonds5

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

2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide (PubChem CID 16854865) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide.

Molecular Properties

Compound Name2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide
PubChem CID16854865
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide
SMILESCOc1ccc(CC(=O)Nc2nnc(-c3cccc(C)c3)o2)cc1C
InChIInChI=1S/C19H19N3O3/c1-12-5-4-6-15(9-12)18-21-22-19(25-18)20-17(23)11-14-7-8-16(24-3)13(2)10-14/h4-10H,11H2,1-3H3,(H,20,22,23)
InChIKeyZZDOGNVEQIBMAP-UHFFFAOYSA-N
XLogP3.54
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide?
The IUPAC name of 2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide (CID 16854865) is 2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide.
What is the SMILES notation for 2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide?
The canonical SMILES for 2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide is COc1ccc(CC(=O)Nc2nnc(-c3cccc(C)c3)o2)cc1C.
What is the InChIKey of 2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide?
The InChIKey is ZZDOGNVEQIBMAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-12-5-4-6-15(9-12)18-21-22-19(25-18)20-17(23)11-14-7-8-16(24-3)13(2)10-14/h4-10H,11H2,1-3H3,(H,20,22,23).
What are the key properties of 2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide?
2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide has a molecular weight of 337.38 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxy-3-methylphenyl)-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]acetamide is sourced from PubChem (CID 16854865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).