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

C17H15N3O3 — CID 890855

IUPACN-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(Oc2ccc(-c3noc(C)n3)cc2)cc1
InChIInChI=1S/C17H15N3O3/c1-11(21)18-14-5-9-16(10-6-14)22-15-7-3-13(4-8-15)17-19-12(2)23-20-17/h3-10H,1-2H3,(H,18,21)
InChIKeySEIDFSYKODUTNC-UHFFFAOYSA-N
MW309.33 g/mol
LogP3.80
Rot. Bonds4

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

N-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide (PubChem CID 890855) has the molecular formula C17H15N3O3 and a molecular weight of 309.33 g/mol. Its IUPAC name is N-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide
PubChem CID890855
Molecular FormulaC17H15N3O3
Molecular Weight309.33 g/mol
Exact Mass309.11
IUPAC NameN-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(Oc2ccc(-c3noc(C)n3)cc2)cc1
InChIInChI=1S/C17H15N3O3/c1-11(21)18-14-5-9-16(10-6-14)22-15-7-3-13(4-8-15)17-19-12(2)23-20-17/h3-10H,1-2H3,(H,18,21)
InChIKeySEIDFSYKODUTNC-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

N-[4-[4-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]phenoxy]phenyl]acetamide
CID 53103317
N-[4-[4-[5-(4-ethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenoxy]phenyl]acetamide
CID 53103323
[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] acetate
CID 154709033
[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] 5-acetamido-2-fluorobenzoate
CID 47571605
N-(3-acetamidophenyl)-2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetamide
CID 17443328
1-(4-bromophenyl)-3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]urea
CID 46361356
N-[4-[4-[5-(thiophen-2-ylmethyl)-1,2,4-oxadiazol-3-yl]phenoxy]phenyl]acetamide
CID 53103325
N-[4-[[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoylamino]phenyl]acetamide
CID 50777698
2-cyano-N-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]acetamide
CID 168523907
N-[4-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]piperazine-1-carbonyl]phenyl]acetamide
CID 53041887
N-methyl-2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetamide
CID 47119130
N-[4-[4-[5-(4-cyano-2-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy]phenyl]acetamide
CID 53103342

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide?
The IUPAC name of N-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide (CID 890855) is N-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide.
What is the SMILES notation for N-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide?
The canonical SMILES for N-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide is CC(=O)Nc1ccc(Oc2ccc(-c3noc(C)n3)cc2)cc1.
What is the InChIKey of N-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide?
The InChIKey is SEIDFSYKODUTNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3/c1-11(21)18-14-5-9-16(10-6-14)22-15-7-3-13(4-8-15)17-19-12(2)23-20-17/h3-10H,1-2H3,(H,18,21).
What are the key properties of N-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide?
N-[4-[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-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide is sourced from PubChem (CID 890855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).