3,4-dimethylthiophene-2-carboxamide

C7H9NOS — CID 140551630

IUPAC3,4-dimethylthiophene-2-carboxamide
SMILESCc1csc(C(N)=O)c1C
InChIInChI=1S/C7H9NOS/c1-4-3-10-6(5(4)2)7(8)9/h3H,1-2H3,(H2,8,9)
InChIKeyCLCWXDZGQWZIMI-UHFFFAOYSA-N
MW155.22 g/mol
LogP1.46
Rot. Bonds1

About 3,4-dimethylthiophene-2-carboxamide

3,4-dimethylthiophene-2-carboxamide (PubChem CID 140551630) has the molecular formula C7H9NOS and a molecular weight of 155.22 g/mol. Its IUPAC name is 3,4-dimethylthiophene-2-carboxamide.

Molecular Properties

Compound Name3,4-dimethylthiophene-2-carboxamide
PubChem CID140551630
Molecular FormulaC7H9NOS
Molecular Weight155.22 g/mol
Exact Mass155.04
IUPAC Name3,4-dimethylthiophene-2-carboxamide
SMILESCc1csc(C(N)=O)c1C
InChIInChI=1S/C7H9NOS/c1-4-3-10-6(5(4)2)7(8)9/h3H,1-2H3,(H2,8,9)
InChIKeyCLCWXDZGQWZIMI-UHFFFAOYSA-N
XLogP1.46
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.22
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,4-dimethylthiophene-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 3,4-dimethylthiophene-2-carboxamide?
The IUPAC name of 3,4-dimethylthiophene-2-carboxamide (CID 140551630) is 3,4-dimethylthiophene-2-carboxamide.
What is the SMILES notation for 3,4-dimethylthiophene-2-carboxamide?
The canonical SMILES for 3,4-dimethylthiophene-2-carboxamide is Cc1csc(C(N)=O)c1C.
What is the InChIKey of 3,4-dimethylthiophene-2-carboxamide?
The InChIKey is CLCWXDZGQWZIMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NOS/c1-4-3-10-6(5(4)2)7(8)9/h3H,1-2H3,(H2,8,9).
What are the key properties of 3,4-dimethylthiophene-2-carboxamide?
3,4-dimethylthiophene-2-carboxamide has a molecular weight of 155.22 g/mol, XLogP of 1.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethylthiophene-2-carboxamide is sourced from PubChem (CID 140551630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).