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

C17H15N3O3 — CID 2985242

IUPACN-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
InChIInChI=1S/C17H15N3O3/c1-12(21)18-14-7-9-15(10-8-14)22-11-16-19-20-17(23-16)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,21)
InChIKeyOVPJUWMJAFPBJJ-UHFFFAOYSA-N
MW309.33 g/mol
LogP3.27
Rot. Bonds5

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

N-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide (PubChem CID 2985242) has the molecular formula C17H15N3O3 and a molecular weight of 309.33 g/mol. Its IUPAC name is N-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide
PubChem CID2985242
Molecular FormulaC17H15N3O3
Molecular Weight309.33 g/mol
Exact Mass309.11
IUPAC NameN-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1
InChIInChI=1S/C17H15N3O3/c1-12(21)18-14-7-9-15(10-8-14)22-11-16-19-20-17(23-16)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,21)
InChIKeyOVPJUWMJAFPBJJ-UHFFFAOYSA-N
XLogP3.27
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide?
The IUPAC name of N-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide (CID 2985242) is N-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide.
What is the SMILES notation for N-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide?
The canonical SMILES for N-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide is CC(=O)Nc1ccc(OCc2nnc(-c3ccccc3)o2)cc1.
What is the InChIKey of N-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide?
The InChIKey is OVPJUWMJAFPBJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3/c1-12(21)18-14-7-9-15(10-8-14)22-11-16-19-20-17(23-16)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,21).
What are the key properties of N-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide?
N-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide has a molecular weight of 309.33 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide is sourced from PubChem (CID 2985242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).