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

C9H8N2OS2 — CID 2529101

IUPAC5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide
SMILESCc1ccc(C(=O)Nc2nccs2)s1
InChIInChI=1S/C9H8N2OS2/c1-6-2-3-7(14-6)8(12)11-9-10-4-5-13-9/h2-5H,1H3,(H,10,11,12)
InChIKeyLJHKKHFSZGKOKA-UHFFFAOYSA-N
MW224.31 g/mol
LogP2.77
Rot. Bonds2

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

5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide (PubChem CID 2529101) has the molecular formula C9H8N2OS2 and a molecular weight of 224.31 g/mol. Its IUPAC name is 5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide
PubChem CID2529101
Molecular FormulaC9H8N2OS2
Molecular Weight224.31 g/mol
Exact Mass224.01
IUPAC Name5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide
SMILESCc1ccc(C(=O)Nc2nccs2)s1
InChIInChI=1S/C9H8N2OS2/c1-6-2-3-7(14-6)8(12)11-9-10-4-5-13-9/h2-5H,1H3,(H,10,11,12)
InChIKeyLJHKKHFSZGKOKA-UHFFFAOYSA-N
XLogP2.77
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide?
The IUPAC name of 5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide (CID 2529101) is 5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide.
What is the SMILES notation for 5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide?
The canonical SMILES for 5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide is Cc1ccc(C(=O)Nc2nccs2)s1.
What is the InChIKey of 5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide?
The InChIKey is LJHKKHFSZGKOKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS2/c1-6-2-3-7(14-6)8(12)11-9-10-4-5-13-9/h2-5H,1H3,(H,10,11,12).
What are the key properties of 5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide?
5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide has a molecular weight of 224.31 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide is sourced from PubChem (CID 2529101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).