3-thiophen-2-ylbenzamide

C11H9NOS — CID 4862018

IUPAC3-thiophen-2-ylbenzamide
SMILESNC(=O)c1cccc(-c2cccs2)c1
InChIInChI=1S/C11H9NOS/c12-11(13)9-4-1-3-8(7-9)10-5-2-6-14-10/h1-7H,(H2,12,13)
InChIKeyJSGZVMJYZDEIMK-UHFFFAOYSA-N
MW203.27 g/mol
LogP2.51
Rot. Bonds2

About 3-thiophen-2-ylbenzamide

3-thiophen-2-ylbenzamide (PubChem CID 4862018) has the molecular formula C11H9NOS and a molecular weight of 203.27 g/mol. Its IUPAC name is 3-thiophen-2-ylbenzamide.

Molecular Properties

Compound Name3-thiophen-2-ylbenzamide
PubChem CID4862018
Molecular FormulaC11H9NOS
Molecular Weight203.27 g/mol
Exact Mass203.04
IUPAC Name3-thiophen-2-ylbenzamide
SMILESNC(=O)c1cccc(-c2cccs2)c1
InChIInChI=1S/C11H9NOS/c12-11(13)9-4-1-3-8(7-9)10-5-2-6-14-10/h1-7H,(H2,12,13)
InChIKeyJSGZVMJYZDEIMK-UHFFFAOYSA-N
XLogP2.51
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.27
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 703965
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CID 25002768
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CID 790437
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CID 728650
CID 728650
CID 22374565
CID 22374565
CID 644720
CID 644720
CID 922960
CID 922960
CID 2511029
CID 2511029
CID 3786
CID 3786
CID 896320
CID 896320
CID 3790018
CID 3790018
CID 47110310
CID 47110310

Frequently Asked Questions

What is the IUPAC name of 3-thiophen-2-ylbenzamide?
The IUPAC name of 3-thiophen-2-ylbenzamide (CID 4862018) is 3-thiophen-2-ylbenzamide.
What is the SMILES notation for 3-thiophen-2-ylbenzamide?
The canonical SMILES for 3-thiophen-2-ylbenzamide is NC(=O)c1cccc(-c2cccs2)c1.
What is the InChIKey of 3-thiophen-2-ylbenzamide?
The InChIKey is JSGZVMJYZDEIMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NOS/c12-11(13)9-4-1-3-8(7-9)10-5-2-6-14-10/h1-7H,(H2,12,13).
What are the key properties of 3-thiophen-2-ylbenzamide?
3-thiophen-2-ylbenzamide has a molecular weight of 203.27 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-thiophen-2-ylbenzamide is sourced from PubChem (CID 4862018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).