N-ethoxy-2-thiophen-2-ylacetamide

C8H11NO2S — CID 60716971

IUPACN-ethoxy-2-thiophen-2-ylacetamide
SMILESCCONC(=O)Cc1cccs1
InChIInChI=1S/C8H11NO2S/c1-2-11-9-8(10)6-7-4-3-5-12-7/h3-5H,2,6H2,1H3,(H,9,10)
InChIKeyKVUJOPHJOZLSNV-UHFFFAOYSA-N
MW185.25 g/mol
LogP1.36
Rot. Bonds4

About N-ethoxy-2-thiophen-2-ylacetamide

N-ethoxy-2-thiophen-2-ylacetamide (PubChem CID 60716971) has the molecular formula C8H11NO2S and a molecular weight of 185.25 g/mol. Its IUPAC name is N-ethoxy-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-ethoxy-2-thiophen-2-ylacetamide
PubChem CID60716971
Molecular FormulaC8H11NO2S
Molecular Weight185.25 g/mol
Exact Mass185.05
IUPAC NameN-ethoxy-2-thiophen-2-ylacetamide
SMILESCCONC(=O)Cc1cccs1
InChIInChI=1S/C8H11NO2S/c1-2-11-9-8(10)6-7-4-3-5-12-7/h3-5H,2,6H2,1H3,(H,9,10)
InChIKeyKVUJOPHJOZLSNV-UHFFFAOYSA-N
XLogP1.36
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.25
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethoxy-2-thiophen-2-ylacetamide?
The IUPAC name of N-ethoxy-2-thiophen-2-ylacetamide (CID 60716971) is N-ethoxy-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-ethoxy-2-thiophen-2-ylacetamide?
The canonical SMILES for N-ethoxy-2-thiophen-2-ylacetamide is CCONC(=O)Cc1cccs1.
What is the InChIKey of N-ethoxy-2-thiophen-2-ylacetamide?
The InChIKey is KVUJOPHJOZLSNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2S/c1-2-11-9-8(10)6-7-4-3-5-12-7/h3-5H,2,6H2,1H3,(H,9,10).
What are the key properties of N-ethoxy-2-thiophen-2-ylacetamide?
N-ethoxy-2-thiophen-2-ylacetamide has a molecular weight of 185.25 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-2-thiophen-2-ylacetamide is sourced from PubChem (CID 60716971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).