N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide

C11H9BrN2OS — CID 79048508

IUPACN-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide
SMILESCc1nc(NC(=O)c2ccsc2)ccc1Br
InChIInChI=1S/C11H9BrN2OS/c1-7-9(12)2-3-10(13-7)14-11(15)8-4-5-16-6-8/h2-6H,1H3,(H,13,14,15)
InChIKeyVGEFCFADXZBJGL-UHFFFAOYSA-N
MW297.18 g/mol
LogP3.47
Rot. Bonds2

About N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide

N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide (PubChem CID 79048508) has the molecular formula C11H9BrN2OS and a molecular weight of 297.18 g/mol. Its IUPAC name is N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide
PubChem CID79048508
Molecular FormulaC11H9BrN2OS
Molecular Weight297.18 g/mol
Exact Mass295.96
IUPAC NameN-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide
SMILESCc1nc(NC(=O)c2ccsc2)ccc1Br
InChIInChI=1S/C11H9BrN2OS/c1-7-9(12)2-3-10(13-7)14-11(15)8-4-5-16-6-8/h2-6H,1H3,(H,13,14,15)
InChIKeyVGEFCFADXZBJGL-UHFFFAOYSA-N
XLogP3.47
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.18
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-N-(5-bromo-6-methyl-2-pyridinyl)benzamide
CID 4509258
N-(5-bromo-6-methyl-2-pyridinyl)-5-iodothiophene-3-carboxamide
CID 79116772
N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide
CID 79049112
N-(5-bromo-6-methyl-2-pyridinyl)-6-methylpyridine-3-carboxamide
CID 79048580
3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide
CID 113460607
N-(5-bromo-6-methyl-2-pyridinyl)-3,4-dichlorobenzamide
CID 4509260
N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxy-4-methylbenzamide
CID 79048356
N-(5-bromo-6-methyl-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide
CID 79049145
N-(5-bromo-6-methyl-2-pyridinyl)-2-chloropyridine-4-carboxamide
CID 71987347
N-(5-bromo-6-methyl-2-pyridinyl)-4-ethoxybenzamide
CID 925722
N-(5-bromo-6-methyl-2-pyridinyl)-2,4,6-trimethylbenzamide
CID 79048667
N-(3-bromo-4-methylphenyl)thiophene-3-carboxamide
CID 55027767

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide?
The IUPAC name of N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide (CID 79048508) is N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide?
The canonical SMILES for N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide is Cc1nc(NC(=O)c2ccsc2)ccc1Br.
What is the InChIKey of N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide?
The InChIKey is VGEFCFADXZBJGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrN2OS/c1-7-9(12)2-3-10(13-7)14-11(15)8-4-5-16-6-8/h2-6H,1H3,(H,13,14,15).
What are the key properties of N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide?
N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide has a molecular weight of 297.18 g/mol, XLogP of 3.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide is sourced from PubChem (CID 79048508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).