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

C17H15N3O3 — CID 655521

IUPACN-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide
SMILESCC(=O)Nc1cccc(Oc2ccc(-c3noc(C)n3)cc2)c1
InChIInChI=1S/C17H15N3O3/c1-11(21)18-14-4-3-5-16(10-14)22-15-8-6-13(7-9-15)17-19-12(2)23-20-17/h3-10H,1-2H3,(H,18,21)
InChIKeyIEDQOSUJWFLEGQ-UHFFFAOYSA-N
MW309.33 g/mol
LogP3.80
Rot. Bonds4

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

N-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide (PubChem CID 655521) has the molecular formula C17H15N3O3 and a molecular weight of 309.33 g/mol. Its IUPAC name is N-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide
PubChem CID655521
Molecular FormulaC17H15N3O3
Molecular Weight309.33 g/mol
Exact Mass309.11
IUPAC NameN-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide
SMILESCC(=O)Nc1cccc(Oc2ccc(-c3noc(C)n3)cc2)c1
InChIInChI=1S/C17H15N3O3/c1-11(21)18-14-4-3-5-16(10-14)22-15-8-6-13(7-9-15)17-19-12(2)23-20-17/h3-10H,1-2H3,(H,18,21)
InChIKeyIEDQOSUJWFLEGQ-UHFFFAOYSA-N
XLogP3.80
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]-N-(3-methoxyphenyl)propanamide
CID 3159507
3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(3-methylphenyl)propanamide
CID 665665
3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
CID 666363
2-Ethoxy-6-(4-methoxyphenyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine
CID 913865
N-(3,4-dimethylphenyl)-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide
CID 1250111
1-{[3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4-phenylpiperazine
CID 2215139
3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-phenylpiperidine-1-carboxamide
CID 3226073
N~2~-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N~2~-methyl-N~1~-[3-(trifluoromethyl)phenyl]glycinamide
CID 3238096
3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-N-(3-methylphenyl)propanamide
CID 3239198
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide
CID 3239217
3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-phenoxyphenyl)propanamide
CID 3241283
3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(3-methoxyphenyl)propanamide
CID 3806837

Frequently Asked Questions

What is the IUPAC name of N-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide?
The IUPAC name of N-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide (CID 655521) is N-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide.
What is the SMILES notation for N-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide?
The canonical SMILES for N-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide is CC(=O)Nc1cccc(Oc2ccc(-c3noc(C)n3)cc2)c1.
What is the InChIKey of N-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide?
The InChIKey is IEDQOSUJWFLEGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3/c1-11(21)18-14-4-3-5-16(10-14)22-15-8-6-13(7-9-15)17-19-12(2)23-20-17/h3-10H,1-2H3,(H,18,21).
What are the key properties of N-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide?
N-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide has a molecular weight of 309.33 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide is sourced from PubChem (CID 655521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).