2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide

C15H16N2O3S — CID 8719932

IUPAC2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide
SMILESCCOc1ccc(CC(=O)Nc2sccc2C(N)=O)cc1
InChIInChI=1S/C15H16N2O3S/c1-2-20-11-5-3-10(4-6-11)9-13(18)17-15-12(14(16)19)7-8-21-15/h3-8H,2,9H2,1H3,(H2,16,19)(H,17,18)
InChIKeyRYUWCWCMMIGWJX-UHFFFAOYSA-N
MW304.37 g/mol
LogP2.43
Rot. Bonds6

About 2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide

2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide (PubChem CID 8719932) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is 2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide.

Molecular Properties

Compound Name2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide
PubChem CID8719932
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC Name2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide
SMILESCCOc1ccc(CC(=O)Nc2sccc2C(N)=O)cc1
InChIInChI=1S/C15H16N2O3S/c1-2-20-11-5-3-10(4-6-11)9-13(18)17-15-12(14(16)19)7-8-21-15/h3-8H,2,9H2,1H3,(H2,16,19)(H,17,18)
InChIKeyRYUWCWCMMIGWJX-UHFFFAOYSA-N
XLogP2.43
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide?
The IUPAC name of 2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide (CID 8719932) is 2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide.
What is the SMILES notation for 2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide?
The canonical SMILES for 2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide is CCOc1ccc(CC(=O)Nc2sccc2C(N)=O)cc1.
What is the InChIKey of 2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide?
The InChIKey is RYUWCWCMMIGWJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c1-2-20-11-5-3-10(4-6-11)9-13(18)17-15-12(14(16)19)7-8-21-15/h3-8H,2,9H2,1H3,(H2,16,19)(H,17,18).
What are the key properties of 2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide?
2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide has a molecular weight of 304.37 g/mol, XLogP of 2.43, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-ethoxyphenyl)acetyl]amino]thiophene-3-carboxamide is sourced from PubChem (CID 8719932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).