4-[(2-thiophen-2-ylacetyl)amino]benzamide

C13H12N2O2S — CID 670145

IUPAC4-[(2-thiophen-2-ylacetyl)amino]benzamide
SMILESNC(=O)c1ccc(NC(=O)Cc2cccs2)cc1
InChIInChI=1S/C13H12N2O2S/c14-13(17)9-3-5-10(6-4-9)15-12(16)8-11-2-1-7-18-11/h1-7H,8H2,(H2,14,17)(H,15,16)
InChIKeyMFAVEMJVYSWCBQ-UHFFFAOYSA-N
MW260.32 g/mol
LogP2.03
Rot. Bonds4

About 4-[(2-thiophen-2-ylacetyl)amino]benzamide

4-[(2-thiophen-2-ylacetyl)amino]benzamide (PubChem CID 670145) has the molecular formula C13H12N2O2S and a molecular weight of 260.32 g/mol. Its IUPAC name is 4-[(2-thiophen-2-ylacetyl)amino]benzamide.

Molecular Properties

Compound Name4-[(2-thiophen-2-ylacetyl)amino]benzamide
PubChem CID670145
Molecular FormulaC13H12N2O2S
Molecular Weight260.32 g/mol
Exact Mass260.06
IUPAC Name4-[(2-thiophen-2-ylacetyl)amino]benzamide
SMILESNC(=O)c1ccc(NC(=O)Cc2cccs2)cc1
InChIInChI=1S/C13H12N2O2S/c14-13(17)9-3-5-10(6-4-9)15-12(16)8-11-2-1-7-18-11/h1-7H,8H2,(H2,14,17)(H,15,16)
InChIKeyMFAVEMJVYSWCBQ-UHFFFAOYSA-N
XLogP2.03
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-thiophen-2-ylacetyl)amino]benzamide?
The IUPAC name of 4-[(2-thiophen-2-ylacetyl)amino]benzamide (CID 670145) is 4-[(2-thiophen-2-ylacetyl)amino]benzamide.
What is the SMILES notation for 4-[(2-thiophen-2-ylacetyl)amino]benzamide?
The canonical SMILES for 4-[(2-thiophen-2-ylacetyl)amino]benzamide is NC(=O)c1ccc(NC(=O)Cc2cccs2)cc1.
What is the InChIKey of 4-[(2-thiophen-2-ylacetyl)amino]benzamide?
The InChIKey is MFAVEMJVYSWCBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2S/c14-13(17)9-3-5-10(6-4-9)15-12(16)8-11-2-1-7-18-11/h1-7H,8H2,(H2,14,17)(H,15,16).
What are the key properties of 4-[(2-thiophen-2-ylacetyl)amino]benzamide?
4-[(2-thiophen-2-ylacetyl)amino]benzamide has a molecular weight of 260.32 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-thiophen-2-ylacetyl)amino]benzamide is sourced from PubChem (CID 670145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).