N-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide

C11H9BrN2OS — CID 17218099

IUPACN-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(Br)cn2)cs1
InChIInChI=1S/C11H9BrN2OS/c1-7-4-8(6-16-7)11(15)14-10-3-2-9(12)5-13-10/h2-6H,1H3,(H,13,14,15)
InChIKeyJVPQPPPPJSFKPM-UHFFFAOYSA-N
MW297.18 g/mol
LogP3.47
Rot. Bonds2

About N-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide

N-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide (PubChem CID 17218099) has the molecular formula C11H9BrN2OS and a molecular weight of 297.18 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide
PubChem CID17218099
Molecular FormulaC11H9BrN2OS
Molecular Weight297.18 g/mol
Exact Mass295.96
IUPAC NameN-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(Br)cn2)cs1
InChIInChI=1S/C11H9BrN2OS/c1-7-4-8(6-16-7)11(15)14-10-3-2-9(12)5-13-10/h2-6H,1H3,(H,13,14,15)
InChIKeyJVPQPPPPJSFKPM-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

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CID 953685
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4-[(5-bromo-2-pyridinyl)carbamoyl]pyridine-2-carboxylic acid
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N-(5-acetyl-2-pyridinyl)-5-bromopyridine-2-carboxamide
CID 75514307
N-(5-bromo-2-pyridinyl)-4-propan-2-ylbenzamide
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3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide
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N-(5-bromo-2-pyridinyl)-4-methylsulfonylbenzamide
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N-(5-bromo-2-pyridinyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide (CID 17218099) is N-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide is Cc1cc(C(=O)Nc2ccc(Br)cn2)cs1.
What is the InChIKey of N-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide?
The InChIKey is JVPQPPPPJSFKPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrN2OS/c1-7-4-8(6-16-7)11(15)14-10-3-2-9(12)5-13-10/h2-6H,1H3,(H,13,14,15).
What are the key properties of N-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide?
N-(5-bromo-2-pyridinyl)-5-methylthiophene-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-2-pyridinyl)-5-methylthiophene-3-carboxamide is sourced from PubChem (CID 17218099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).