2-acetamido-N-benzyl-2-thiophen-2-ylacetamide

C15H16N2O2S — CID 14212838

IUPAC2-acetamido-N-benzyl-2-thiophen-2-ylacetamide
SMILESCC(=O)NC(C(=O)NCc1ccccc1)c1cccs1
InChIInChI=1S/C15H16N2O2S/c1-11(18)17-14(13-8-5-9-20-13)15(19)16-10-12-6-3-2-4-7-12/h2-9,14H,10H2,1H3,(H,16,19)(H,17,18)
InChIKeyWREIXPFSPVYLNR-UHFFFAOYSA-N
MW288.37 g/mol
LogP2.24
Rot. Bonds5

About 2-acetamido-N-benzyl-2-thiophen-2-ylacetamide

2-acetamido-N-benzyl-2-thiophen-2-ylacetamide (PubChem CID 14212838) has the molecular formula C15H16N2O2S and a molecular weight of 288.37 g/mol. Its IUPAC name is 2-acetamido-N-benzyl-2-thiophen-2-ylacetamide.

Molecular Properties

Compound Name2-acetamido-N-benzyl-2-thiophen-2-ylacetamide
PubChem CID14212838
Molecular FormulaC15H16N2O2S
Molecular Weight288.37 g/mol
Exact Mass288.09
IUPAC Name2-acetamido-N-benzyl-2-thiophen-2-ylacetamide
SMILESCC(=O)NC(C(=O)NCc1ccccc1)c1cccs1
InChIInChI=1S/C15H16N2O2S/c1-11(18)17-14(13-8-5-9-20-13)15(19)16-10-12-6-3-2-4-7-12/h2-9,14H,10H2,1H3,(H,16,19)(H,17,18)
InChIKeyWREIXPFSPVYLNR-UHFFFAOYSA-N
XLogP2.24
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-benzyl-2-thiophen-2-ylacetamide?
The IUPAC name of 2-acetamido-N-benzyl-2-thiophen-2-ylacetamide (CID 14212838) is 2-acetamido-N-benzyl-2-thiophen-2-ylacetamide.
What is the SMILES notation for 2-acetamido-N-benzyl-2-thiophen-2-ylacetamide?
The canonical SMILES for 2-acetamido-N-benzyl-2-thiophen-2-ylacetamide is CC(=O)NC(C(=O)NCc1ccccc1)c1cccs1.
What is the InChIKey of 2-acetamido-N-benzyl-2-thiophen-2-ylacetamide?
The InChIKey is WREIXPFSPVYLNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S/c1-11(18)17-14(13-8-5-9-20-13)15(19)16-10-12-6-3-2-4-7-12/h2-9,14H,10H2,1H3,(H,16,19)(H,17,18).
What are the key properties of 2-acetamido-N-benzyl-2-thiophen-2-ylacetamide?
2-acetamido-N-benzyl-2-thiophen-2-ylacetamide has a molecular weight of 288.37 g/mol, XLogP of 2.24, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-benzyl-2-thiophen-2-ylacetamide is sourced from PubChem (CID 14212838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).