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

C19H19N3O4 — CID 4796947

IUPACN-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide
SMILESCCOc1ccc(-c2nnc(NC(=O)Cc3ccc(OC)cc3)o2)cc1
InChIInChI=1S/C19H19N3O4/c1-3-25-16-10-6-14(7-11-16)18-21-22-19(26-18)20-17(23)12-13-4-8-15(24-2)9-5-13/h4-11H,3,12H2,1-2H3,(H,20,22,23)
InChIKeyCYCMOGQCHVEALQ-UHFFFAOYSA-N
MW353.38 g/mol
LogP3.33
Rot. Bonds7

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

N-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide (PubChem CID 4796947) has the molecular formula C19H19N3O4 and a molecular weight of 353.38 g/mol. Its IUPAC name is N-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide
PubChem CID4796947
Molecular FormulaC19H19N3O4
Molecular Weight353.38 g/mol
Exact Mass353.14
IUPAC NameN-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide
SMILESCCOc1ccc(-c2nnc(NC(=O)Cc3ccc(OC)cc3)o2)cc1
InChIInChI=1S/C19H19N3O4/c1-3-25-16-10-6-14(7-11-16)18-21-22-19(26-18)20-17(23)12-13-4-8-15(24-2)9-5-13/h4-11H,3,12H2,1-2H3,(H,20,22,23)
InChIKeyCYCMOGQCHVEALQ-UHFFFAOYSA-N
XLogP3.33
TPSA86.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide?
The IUPAC name of N-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide (CID 4796947) is N-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide is CCOc1ccc(-c2nnc(NC(=O)Cc3ccc(OC)cc3)o2)cc1.
What is the InChIKey of N-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide?
The InChIKey is CYCMOGQCHVEALQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4/c1-3-25-16-10-6-14(7-11-16)18-21-22-19(26-18)20-17(23)12-13-4-8-15(24-2)9-5-13/h4-11H,3,12H2,1-2H3,(H,20,22,23).
What are the key properties of N-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide?
N-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide has a molecular weight of 353.38 g/mol, XLogP of 3.33, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 4796947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).