N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide

C14H15NO2S — CID 898929

IUPACN-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide
SMILESCCOc1cccc(NC(=O)Cc2cccs2)c1
InChIInChI=1S/C14H15NO2S/c1-2-17-12-6-3-5-11(9-12)15-14(16)10-13-7-4-8-18-13/h3-9H,2,10H2,1H3,(H,15,16)
InChIKeyQAOJQSAMAWKLDW-UHFFFAOYSA-N
MW261.35 g/mol
LogP3.33
Rot. Bonds5

About N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide

N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide (PubChem CID 898929) has the molecular formula C14H15NO2S and a molecular weight of 261.35 g/mol. Its IUPAC name is N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide
PubChem CID898929
Molecular FormulaC14H15NO2S
Molecular Weight261.35 g/mol
Exact Mass261.08
IUPAC NameN-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide
SMILESCCOc1cccc(NC(=O)Cc2cccs2)c1
InChIInChI=1S/C14H15NO2S/c1-2-17-12-6-3-5-11(9-12)15-14(16)10-13-7-4-8-18-13/h3-9H,2,10H2,1H3,(H,15,16)
InChIKeyQAOJQSAMAWKLDW-UHFFFAOYSA-N
XLogP3.33
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide (CID 898929) is N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide is CCOc1cccc(NC(=O)Cc2cccs2)c1.
What is the InChIKey of N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide?
The InChIKey is QAOJQSAMAWKLDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S/c1-2-17-12-6-3-5-11(9-12)15-14(16)10-13-7-4-8-18-13/h3-9H,2,10H2,1H3,(H,15,16).
What are the key properties of N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide?
N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide has a molecular weight of 261.35 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxyphenyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 898929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).