5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide

C12H14N2OS2 — CID 2438682

IUPAC5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide
SMILESCCc1sc(C(=O)Nc2nc(C)cs2)cc1C
InChIInChI=1S/C12H14N2OS2/c1-4-9-7(2)5-10(17-9)11(15)14-12-13-8(3)6-16-12/h5-6H,4H2,1-3H3,(H,13,14,15)
InChIKeyJSORPOBXBHIXLE-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.64
Rot. Bonds3

About 5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide

5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide (PubChem CID 2438682) has the molecular formula C12H14N2OS2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide
PubChem CID2438682
Molecular FormulaC12H14N2OS2
Molecular Weight266.39 g/mol
Exact Mass266.05
IUPAC Name5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide
SMILESCCc1sc(C(=O)Nc2nc(C)cs2)cc1C
InChIInChI=1S/C12H14N2OS2/c1-4-9-7(2)5-10(17-9)11(15)14-12-13-8(3)6-16-12/h5-6H,4H2,1-3H3,(H,13,14,15)
InChIKeyJSORPOBXBHIXLE-UHFFFAOYSA-N
XLogP3.64
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)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

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide?
The IUPAC name of 5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide (CID 2438682) is 5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide.
What is the SMILES notation for 5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide?
The canonical SMILES for 5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide is CCc1sc(C(=O)Nc2nc(C)cs2)cc1C.
What is the InChIKey of 5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide?
The InChIKey is JSORPOBXBHIXLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2OS2/c1-4-9-7(2)5-10(17-9)11(15)14-12-13-8(3)6-16-12/h5-6H,4H2,1-3H3,(H,13,14,15).
What are the key properties of 5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide?
5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide has a molecular weight of 266.39 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide is sourced from PubChem (CID 2438682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).