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

C9H9N3OS2 — CID 91900874

IUPAC3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide
SMILESCc1nsc(NC(=O)c2sccc2C)n1
InChIInChI=1S/C9H9N3OS2/c1-5-3-4-14-7(5)8(13)11-9-10-6(2)12-15-9/h3-4H,1-2H3,(H,10,11,12,13)
InChIKeyQRSKXCHFNGBWTC-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.47
Rot. Bonds2

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

3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide (PubChem CID 91900874) has the molecular formula C9H9N3OS2 and a molecular weight of 239.32 g/mol. Its IUPAC name is 3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide
PubChem CID91900874
Molecular FormulaC9H9N3OS2
Molecular Weight239.32 g/mol
Exact Mass239.02
IUPAC Name3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide
SMILESCc1nsc(NC(=O)c2sccc2C)n1
InChIInChI=1S/C9H9N3OS2/c1-5-3-4-14-7(5)8(13)11-9-10-6(2)12-15-9/h3-4H,1-2H3,(H,10,11,12,13)
InChIKeyQRSKXCHFNGBWTC-UHFFFAOYSA-N
XLogP2.47
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-N-pyridin-4-ylthiophene-2-carboxamide
CID 30388319
methyl 4-methyl-2-[(3-methylthiophene-2-carbonyl)amino]-1,3-thiazole-5-carboxylate
CID 78808645
N-[4-(N-hydroxy-C-methylcarbonimidoyl)-1,3-thiazol-2-yl]-3-methylthiophene-2-carboxamide
CID 77047051
4-fluoro-2-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide
CID 115745910
3-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide
CID 34109190
N-(4-hydroxyphenyl)-3-methylthiophene-2-carboxamide
CID 28739515
3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide
CID 8714089
N-(6-amino-1,3-benzothiazol-2-yl)-3-methylthiophene-2-carboxamide
CID 24692699
N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-3-methylthiophene-2-carboxamide
CID 7916082
N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 115661254
3-methyl-N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-2-carboxamide
CID 43593340
N-(4-chlorophenyl)-3-methylthiophene-2-carboxamide
CID 26087540

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide?
The IUPAC name of 3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide (CID 91900874) is 3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide?
The canonical SMILES for 3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide is Cc1nsc(NC(=O)c2sccc2C)n1.
What is the InChIKey of 3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide?
The InChIKey is QRSKXCHFNGBWTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3OS2/c1-5-3-4-14-7(5)8(13)11-9-10-6(2)12-15-9/h3-4H,1-2H3,(H,10,11,12,13).
What are the key properties of 3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide?
3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide has a molecular weight of 239.32 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide is sourced from PubChem (CID 91900874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).