4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide

C14H11N3O2S — CID 7711079

IUPAC4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide
SMILESCc1ccc(C(=O)Nc2nonc2-c2cccs2)cc1
InChIInChI=1S/C14H11N3O2S/c1-9-4-6-10(7-5-9)14(18)15-13-12(16-19-17-13)11-3-2-8-20-11/h2-8H,1H3,(H,15,17,18)
InChIKeyPKSWAGIKYWHOHA-UHFFFAOYSA-N
MW285.33 g/mol
LogP3.36
Rot. Bonds3

About 4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide

4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide (PubChem CID 7711079) has the molecular formula C14H11N3O2S and a molecular weight of 285.33 g/mol. Its IUPAC name is 4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide.

Molecular Properties

Compound Name4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide
PubChem CID7711079
Molecular FormulaC14H11N3O2S
Molecular Weight285.33 g/mol
Exact Mass285.06
IUPAC Name4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide
SMILESCc1ccc(C(=O)Nc2nonc2-c2cccs2)cc1
InChIInChI=1S/C14H11N3O2S/c1-9-4-6-10(7-5-9)14(18)15-13-12(16-19-17-13)11-3-2-8-20-11/h2-8H,1H3,(H,15,17,18)
InChIKeyPKSWAGIKYWHOHA-UHFFFAOYSA-N
XLogP3.36
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide
CID 7711035
2-bromo-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide
CID 7709568
N-(4,5-dithiophen-2-yl-1,3-thiazol-2-yl)-4-methylbenzamide
CID 7918509
5-chloro-3-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)-1-benzofuran-2-carboxamide
CID 17013485
4-methyl-N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 751469
N-[4-(4-methoxy-3-methylphenyl)-1,2,5-oxadiazol-3-yl]-4-methylbenzamide
CID 17013592
4-methyl-N-(4-thiophen-2-ylpyrimidin-2-yl)benzamide
CID 3698321
2-(4-ethylphenoxy)-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)acetamide
CID 7711231
4-methyl-N-[2-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)ethyl]benzamide
CID 51064599
4-methyl-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]benzamide
CID 8911642
N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide
CID 7708593
N-(3-hydroxy-2-pyridinyl)-4-methylbenzamide
CID 25342946

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide?
The IUPAC name of 4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide (CID 7711079) is 4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide.
What is the SMILES notation for 4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide?
The canonical SMILES for 4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide is Cc1ccc(C(=O)Nc2nonc2-c2cccs2)cc1.
What is the InChIKey of 4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide?
The InChIKey is PKSWAGIKYWHOHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2S/c1-9-4-6-10(7-5-9)14(18)15-13-12(16-19-17-13)11-3-2-8-20-11/h2-8H,1H3,(H,15,17,18).
What are the key properties of 4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide?
4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide has a molecular weight of 285.33 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(4-thiophen-2-yl-1,2,5-oxadiazol-3-yl)benzamide is sourced from PubChem (CID 7711079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).