N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide

C18H15N3O4 — CID 7556222

IUPACN-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
SMILESCC(=O)c1ccc(NC(=O)COc2ccc(-c3nnco3)cc2)cc1
InChIInChI=1S/C18H15N3O4/c1-12(22)13-2-6-15(7-3-13)20-17(23)10-24-16-8-4-14(5-9-16)18-21-19-11-25-18/h2-9,11H,10H2,1H3,(H,20,23)
InChIKeyXSKBNLPONKXUFH-UHFFFAOYSA-N
MW337.34 g/mol
LogP2.96
Rot. Bonds6

About N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide

N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide (PubChem CID 7556222) has the molecular formula C18H15N3O4 and a molecular weight of 337.34 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
PubChem CID7556222
Molecular FormulaC18H15N3O4
Molecular Weight337.34 g/mol
Exact Mass337.11
IUPAC NameN-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
SMILESCC(=O)c1ccc(NC(=O)COc2ccc(-c3nnco3)cc2)cc1
InChIInChI=1S/C18H15N3O4/c1-12(22)13-2-6-15(7-3-13)20-17(23)10-24-16-8-4-14(5-9-16)18-21-19-11-25-18/h2-9,11H,10H2,1H3,(H,20,23)
InChIKeyXSKBNLPONKXUFH-UHFFFAOYSA-N
XLogP2.96
TPSA94.32 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The IUPAC name of N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide (CID 7556222) is N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The canonical SMILES for N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide is CC(=O)c1ccc(NC(=O)COc2ccc(-c3nnco3)cc2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The InChIKey is XSKBNLPONKXUFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O4/c1-12(22)13-2-6-15(7-3-13)20-17(23)10-24-16-8-4-14(5-9-16)18-21-19-11-25-18/h2-9,11H,10H2,1H3,(H,20,23).
What are the key properties of N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide has a molecular weight of 337.34 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide is sourced from PubChem (CID 7556222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).