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

C9H8N2OS2 — CID 68802947

IUPAC5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide
SMILESCc1nc(-c2ccc(C(N)=O)s2)cs1
InChIInChI=1S/C9H8N2OS2/c1-5-11-6(4-13-5)7-2-3-8(14-7)9(10)12/h2-4H,1H3,(H2,10,12)
InChIKeyIXTREYULWGOYAM-UHFFFAOYSA-N
MW224.31 g/mol
LogP2.28
Rot. Bonds2

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

5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide (PubChem CID 68802947) has the molecular formula C9H8N2OS2 and a molecular weight of 224.31 g/mol. Its IUPAC name is 5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide
PubChem CID68802947
Molecular FormulaC9H8N2OS2
Molecular Weight224.31 g/mol
Exact Mass224.01
IUPAC Name5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide
SMILESCc1nc(-c2ccc(C(N)=O)s2)cs1
InChIInChI=1S/C9H8N2OS2/c1-5-11-6(4-13-5)7-2-3-8(14-7)9(10)12/h2-4H,1H3,(H2,10,12)
InChIKeyIXTREYULWGOYAM-UHFFFAOYSA-N
XLogP2.28
TPSA55.98 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 ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Arotinolol
CID 2239
Arotinolol Hydrochloride
CID 155032
5-ethyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 1246066
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide
CID 5310230
N-methyl-2-(thiophen-2-yl)-1,3-thiazole-4-carboxamide
CID 1473850
Arotinolol, (S)-
CID 12797284
N-{[2-(2-thienyl)-1,3-thiazol-4-yl]methyl}benzamide
CID 2738828
N-{2-[2-(thiophen-2-yl)-1,3-thiazol-4-yl]ethyl}benzamide
CID 8056971
N-[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)ethyl]benzamide
CID 127046713
5-Methylsulfanyl-4-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carbohydrazide
CID 2820235
5-(2-Methyl-1,3-thiazol-4-yl)thiophene-2-carboxaldehyde
CID 2776469
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide
CID 3238025

Frequently Asked Questions

What is the IUPAC name of 5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide?
The IUPAC name of 5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide (CID 68802947) is 5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide.
What is the SMILES notation for 5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide?
The canonical SMILES for 5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide is Cc1nc(-c2ccc(C(N)=O)s2)cs1.
What is the InChIKey of 5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide?
The InChIKey is IXTREYULWGOYAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS2/c1-5-11-6(4-13-5)7-2-3-8(14-7)9(10)12/h2-4H,1H3,(H2,10,12).
What are the key properties of 5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide?
5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide has a molecular weight of 224.31 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxamide is sourced from PubChem (CID 68802947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).