N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide

C20H20N4O4 — CID 110334977

About N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide

N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide (PubChem CID 110334977) has the molecular formula C20H20N4O4 and a molecular weight of 380.40 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide.

Molecular Properties

• Compound Name: N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide
• PubChem CID: 110334977
• Molecular Formula: C20H20N4O4
• Molecular Weight: 380.40 g/mol
• Exact Mass: 380.15
• IUPAC Name: N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide
• SMILES: COc1cccc(-c2nnc(CCC(=O)Nc3ccc(NC(C)=O)cc3)o2)c1
• InChI: InChI=1S/C20H20N4O4/c1-13(25)21-15-6-8-16(9-7-15)22-18(26)10-11-19-23-24-20(28-19)14-4-3-5-17(12-14)27-2/h3-9,12H,10-11H2,1-2H3,(H,21,25)(H,22,26)
• InChIKey: ZFRQCSFBTZNUEA-UHFFFAOYSA-N
• XLogP: 3.27
• TPSA: 106.35 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	380.40
LogP ≤ 5	3.27
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide?

The IUPAC name of N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide (CID 110334977) is N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide.

What is the SMILES notation for N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide?

The canonical SMILES for N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide is COc1cccc(-c2nnc(CCC(=O)Nc3ccc(NC(C)=O)cc3)o2)c1.

What is the InChIKey of N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide?

The InChIKey is ZFRQCSFBTZNUEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O4/c1-13(25)21-15-6-8-16(9-7-15)22-18(26)10-11-19-23-24-20(28-19)14-4-3-5-17(12-14)27-2/h3-9,12H,10-11H2,1-2H3,(H,21,25)(H,22,26).

What are the key properties of N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide?

N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide has a molecular weight of 380.40 g/mol, XLogP of 3.27, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide is sourced from PubChem (CID 110334977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).