5-acetyl-N-cyclopropylthiophene-2-carboxamide

C10H11NO2S — CID 9080124

IUPAC5-acetyl-N-cyclopropylthiophene-2-carboxamide
SMILESCC(=O)c1ccc(C(=O)NC2CC2)s1
InChIInChI=1S/C10H11NO2S/c1-6(12)8-4-5-9(14-8)10(13)11-7-2-3-7/h4-5,7H,2-3H2,1H3,(H,11,13)
InChIKeyOSUPUNMZTKDMLE-UHFFFAOYSA-N
MW209.27 g/mol
LogP1.84
Rot. Bonds3

About 5-acetyl-N-cyclopropylthiophene-2-carboxamide

5-acetyl-N-cyclopropylthiophene-2-carboxamide (PubChem CID 9080124) has the molecular formula C10H11NO2S and a molecular weight of 209.27 g/mol. Its IUPAC name is 5-acetyl-N-cyclopropylthiophene-2-carboxamide.

Molecular Properties

Compound Name5-acetyl-N-cyclopropylthiophene-2-carboxamide
PubChem CID9080124
Molecular FormulaC10H11NO2S
Molecular Weight209.27 g/mol
Exact Mass209.05
IUPAC Name5-acetyl-N-cyclopropylthiophene-2-carboxamide
SMILESCC(=O)c1ccc(C(=O)NC2CC2)s1
InChIInChI=1S/C10H11NO2S/c1-6(12)8-4-5-9(14-8)10(13)11-7-2-3-7/h4-5,7H,2-3H2,1H3,(H,11,13)
InChIKeyOSUPUNMZTKDMLE-UHFFFAOYSA-N
XLogP1.84
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-acetyl-N-cyclopropylthiophene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-acetyl-N-cyclopropylthiophene-2-carboxamide?
The IUPAC name of 5-acetyl-N-cyclopropylthiophene-2-carboxamide (CID 9080124) is 5-acetyl-N-cyclopropylthiophene-2-carboxamide.
What is the SMILES notation for 5-acetyl-N-cyclopropylthiophene-2-carboxamide?
The canonical SMILES for 5-acetyl-N-cyclopropylthiophene-2-carboxamide is CC(=O)c1ccc(C(=O)NC2CC2)s1.
What is the InChIKey of 5-acetyl-N-cyclopropylthiophene-2-carboxamide?
The InChIKey is OSUPUNMZTKDMLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2S/c1-6(12)8-4-5-9(14-8)10(13)11-7-2-3-7/h4-5,7H,2-3H2,1H3,(H,11,13).
What are the key properties of 5-acetyl-N-cyclopropylthiophene-2-carboxamide?
5-acetyl-N-cyclopropylthiophene-2-carboxamide has a molecular weight of 209.27 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetyl-N-cyclopropylthiophene-2-carboxamide is sourced from PubChem (CID 9080124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).