N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide

C11H7N3OS3 — CID 9043733

IUPACN-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1nccs1)c1csc(-c2cccs2)n1
InChIInChI=1S/C11H7N3OS3/c15-9(14-11-12-3-5-17-11)7-6-18-10(13-7)8-2-1-4-16-8/h1-6H,(H,12,14,15)
InChIKeyKWHRDGNZTJTBJG-UHFFFAOYSA-N
MW293.40 g/mol
LogP3.58
Rot. Bonds3

About N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide

N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide (PubChem CID 9043733) has the molecular formula C11H7N3OS3 and a molecular weight of 293.40 g/mol. Its IUPAC name is N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
PubChem CID9043733
Molecular FormulaC11H7N3OS3
Molecular Weight293.40 g/mol
Exact Mass292.98
IUPAC NameN-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1nccs1)c1csc(-c2cccs2)n1
InChIInChI=1S/C11H7N3OS3/c15-9(14-11-12-3-5-17-11)7-6-18-10(13-7)8-2-1-4-16-8/h1-6H,(H,12,14,15)
InChIKeyKWHRDGNZTJTBJG-UHFFFAOYSA-N
XLogP3.58
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.40
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-fluorophenyl)-N-(1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 9043781
N-quinolin-8-yl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 17447095
N-(5-benzyl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 18200258
2-thiophen-2-yl-N-(2,3,4-trifluorophenyl)-1,3-thiazole-4-carboxamide
CID 27826298
N-(2-ethylphenyl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 9047021
3-[(2-thiophen-2-yl-1,3-thiazole-4-carbonyl)amino]-1H-pyrazole-5-carboxylic acid
CID 64523899
N-[4-(cyclopropanecarbonylamino)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 41266351
N-(4-nitrophenyl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 43032437
N-(4-phenoxyphenyl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 117094559
N-[4-(dimethylamino)-3,5-difluorophenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 55907163
N-[(2-methylpropan-2-yl)oxy]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 82723620
N-(1,3-thiazol-2-yl)-4-thiophen-2-ylthiophene-2-carboxamide
CID 71690073

Frequently Asked Questions

What is the IUPAC name of N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide (CID 9043733) is N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide is O=C(Nc1nccs1)c1csc(-c2cccs2)n1.
What is the InChIKey of N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide?
The InChIKey is KWHRDGNZTJTBJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3OS3/c15-9(14-11-12-3-5-17-11)7-6-18-10(13-7)8-2-1-4-16-8/h1-6H,(H,12,14,15).
What are the key properties of N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide?
N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide has a molecular weight of 293.40 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-thiazol-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 9043733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).