2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide

C16H15N3O3S — CID 7711231

IUPAC2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide
SMILESCCc1ccc(OCC(=O)Nc2nonc2-c2cccs2)cc1
InChIInChI=1S/C16H15N3O3S/c1-2-11-5-7-12(8-6-11)21-10-14(20)17-16-15(18-22-19-16)13-4-3-9-23-13/h3-9H,2,10H2,1H3,(H,17,19,20)
InChIKeyMNEHPCAHSWZCHG-UHFFFAOYSA-N
MW329.38 g/mol
LogP3.38
Rot. Bonds6

About 2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide

2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide (PubChem CID 7711231) has the molecular formula C16H15N3O3S and a molecular weight of 329.38 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide
PubChem CID7711231
Molecular FormulaC16H15N3O3S
Molecular Weight329.38 g/mol
Exact Mass329.08
IUPAC Name2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide
SMILESCCc1ccc(OCC(=O)Nc2nonc2-c2cccs2)cc1
InChIInChI=1S/C16H15N3O3S/c1-2-11-5-7-12(8-6-11)21-10-14(20)17-16-15(18-22-19-16)13-4-3-9-23-13/h3-9H,2,10H2,1H3,(H,17,19,20)
InChIKeyMNEHPCAHSWZCHG-UHFFFAOYSA-N
XLogP3.38
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-ethylphenoxy)-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide
CID 5416726
N'-[2-(4-ethylphenoxy)acetyl]-4-thiophen-2-ylbutanehydrazide
CID 9472040
N-[4-(2,5-dimethylphenyl)-1,2,5-oxadiazol-3-yl]-2-(4-methylphenoxy)acetamide
CID 19244508
4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide
CID 7711079
2-(4-ethylphenoxy)-1-thiophen-2-ylethanone
CID 43412734
3-methoxy-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide
CID 7711035
[4-[(Z)-[[2-(4-ethylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate
CID 6272283
benzene;bis(2-(4-chlorophenoxy)-N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]acetamide)
CID 175653131
ethyl 2-[[2-(4-ethylphenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate
CID 28692626
2-(4-ethylphenoxy)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)acetamide
CID 27991376
5-ethyl-2-[[2-(4-ethylphenoxy)acetyl]amino]thiophene-3-carboxylic acid
CID 28858997
N-[4-(4-methoxy-3-methylphenyl)-1,2,5-oxadiazol-3-yl]-2-(4-methoxyphenoxy)acetamide
CID 17013562

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide (CID 7711231) is 2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide is CCc1ccc(OCC(=O)Nc2nonc2-c2cccs2)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide?
The InChIKey is MNEHPCAHSWZCHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3S/c1-2-11-5-7-12(8-6-11)21-10-14(20)17-16-15(18-22-19-16)13-4-3-9-23-13/h3-9H,2,10H2,1H3,(H,17,19,20).
What are the key properties of 2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide?
2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide has a molecular weight of 329.38 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide is sourced from PubChem (CID 7711231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).