5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide

C17H19NO2S — CID 18089551

IUPAC5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1ccc(C(C)=O)s1
InChIInChI=1S/C17H19NO2S/c1-4-12-7-6-8-13(5-2)16(12)18-17(20)15-10-9-14(21-15)11(3)19/h6-10H,4-5H2,1-3H3,(H,18,20)
InChIKeyFFNBCRXQHRUKHQ-UHFFFAOYSA-N
MW301.41 g/mol
LogP4.33
Rot. Bonds5

About 5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide

5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide (PubChem CID 18089551) has the molecular formula C17H19NO2S and a molecular weight of 301.41 g/mol. Its IUPAC name is 5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide
PubChem CID18089551
Molecular FormulaC17H19NO2S
Molecular Weight301.41 g/mol
Exact Mass301.11
IUPAC Name5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1ccc(C(C)=O)s1
InChIInChI=1S/C17H19NO2S/c1-4-12-7-6-8-13(5-2)16(12)18-17(20)15-10-9-14(21-15)11(3)19/h6-10H,4-5H2,1-3H3,(H,18,20)
InChIKeyFFNBCRXQHRUKHQ-UHFFFAOYSA-N
XLogP4.33
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.41
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-acetyl-N-(2,6-diethylphenyl)thiophene-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

Related Compounds

N-(3-acetamidophenyl)-5-acetylthiophene-2-carboxamide
CID 18089390
5-ethyl-N-(2-ethyl-6-methylphenyl)-4-methylthiophene-2-carboxamide
CID 4820644
5-acetyl-N-[(2-fluorophenyl)methyl]thiophene-2-carboxamide
CID 18105799
5-acetyl-N-(3-methylsulfanylphenyl)thiophene-2-carboxamide
CID 9072643
N-(2-ethyl-6-methylphenyl)-5-pyrrolidin-1-ylsulfonylthiophene-2-carboxamide
CID 53066371
N-(2,6-diethylphenyl)-4-oxopentanamide
CID 65419318
5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide
CID 7750910
3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide
CID 61091035
N-(2,6-diethylphenyl)pyridine-2-carboxamide
CID 19224278
N-(2,6-diethylphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole-6-carboxamide
CID 110384682
1-N-(2,6-diethylphenyl)-4-N-propan-2-ylbenzene-1,4-dicarboxamide
CID 109043170
N-(4-acetylphenyl)-N'-(2,6-diethylphenyl)oxamide
CID 108511377

Frequently Asked Questions

What is the IUPAC name of 5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide?
The IUPAC name of 5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide (CID 18089551) is 5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide?
The canonical SMILES for 5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide is CCc1cccc(CC)c1NC(=O)c1ccc(C(C)=O)s1.
What is the InChIKey of 5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide?
The InChIKey is FFNBCRXQHRUKHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2S/c1-4-12-7-6-8-13(5-2)16(12)18-17(20)15-10-9-14(21-15)11(3)19/h6-10H,4-5H2,1-3H3,(H,18,20).
What are the key properties of 5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide?
5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide has a molecular weight of 301.41 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetyl-N-(2,6-diethylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 18089551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).