3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide

C11H8Cl2N2OS — CID 103407346

IUPAC3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide
SMILESCc1csc(C(=O)Nc2cc(Cl)ccn2)c1Cl
InChIInChI=1S/C11H8Cl2N2OS/c1-6-5-17-10(9(6)13)11(16)15-8-4-7(12)2-3-14-8/h2-5H,1H3,(H,14,15,16)
InChIKeyJKMTYEKGJAEIRD-UHFFFAOYSA-N
MW287.17 g/mol
LogP4.01
Rot. Bonds2

About 3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide

3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide (PubChem CID 103407346) has the molecular formula C11H8Cl2N2OS and a molecular weight of 287.17 g/mol. Its IUPAC name is 3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide
PubChem CID103407346
Molecular FormulaC11H8Cl2N2OS
Molecular Weight287.17 g/mol
Exact Mass285.97
IUPAC Name3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide
SMILESCc1csc(C(=O)Nc2cc(Cl)ccn2)c1Cl
InChIInChI=1S/C11H8Cl2N2OS/c1-6-5-17-10(9(6)13)11(16)15-8-4-7(12)2-3-14-8/h2-5H,1H3,(H,14,15,16)
InChIKeyJKMTYEKGJAEIRD-UHFFFAOYSA-N
XLogP4.01
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.17
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chloro-2-pyridinyl)-2-methyl-5-nitrobenzamide
CID 115627296
N-(4-chloro-2-pyridinyl)-3,6-dimethylpyridazine-4-carboxamide
CID 115876919
N-(2-bromo-5-iodophenyl)-3-chloro-4-methylthiophene-2-carboxamide
CID 114258897
N-(4-chloro-2-pyridinyl)-2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 108788196
N-(5-bromo-4-methyl-2-pyridinyl)-4-chloropyridine-2-carboxamide
CID 79734317
2-chloro-N-(4-chloro-2-pyridinyl)-6-methylpyridine-4-carboxamide
CID 104954651
N-(4-chloro-2-pyridinyl)-2-hydroxy-4-methylbenzamide
CID 115883719
2-[[(3-chloro-4-methylthiophene-2-carbonyl)amino]methyl]pyridine-4-carboxylic acid
CID 103400235
5-chloro-N-(4-chloro-2-pyridinyl)-2-fluorobenzamide
CID 113236117
3-chloro-N-(4-chloro-2-pyridinyl)benzamide
CID 3011465
N-(4-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide
CID 115678914
5-[(3-chloro-4-methylthiophene-2-carbonyl)amino]-2-methylbenzoic acid
CID 103400124

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide?
The IUPAC name of 3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide (CID 103407346) is 3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide.
What is the SMILES notation for 3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide?
The canonical SMILES for 3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide is Cc1csc(C(=O)Nc2cc(Cl)ccn2)c1Cl.
What is the InChIKey of 3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide?
The InChIKey is JKMTYEKGJAEIRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N2OS/c1-6-5-17-10(9(6)13)11(16)15-8-4-7(12)2-3-14-8/h2-5H,1H3,(H,14,15,16).
What are the key properties of 3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide?
3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide has a molecular weight of 287.17 g/mol, XLogP of 4.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(4-chloro-2-pyridinyl)-4-methylthiophene-2-carboxamide is sourced from PubChem (CID 103407346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).