2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide

C15H16N2O3S — CID 3163423

IUPAC2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide
SMILESCc1ccc(S(=O)(=O)CC(=O)Nc2cccc(C)n2)cc1
InChIInChI=1S/C15H16N2O3S/c1-11-6-8-13(9-7-11)21(19,20)10-15(18)17-14-5-3-4-12(2)16-14/h3-9H,10H2,1-2H3,(H,16,17,18)
InChIKeyLRDKRTJEUCLYTF-UHFFFAOYSA-N
MW304.37 g/mol
LogP2.11
Rot. Bonds4

About 2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide

2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide (PubChem CID 3163423) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is 2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide
PubChem CID3163423
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC Name2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide
SMILESCc1ccc(S(=O)(=O)CC(=O)Nc2cccc(C)n2)cc1
InChIInChI=1S/C15H16N2O3S/c1-11-6-8-13(9-7-11)21(19,20)10-15(18)17-14-5-3-4-12(2)16-14/h3-9H,10H2,1-2H3,(H,16,17,18)
InChIKeyLRDKRTJEUCLYTF-UHFFFAOYSA-N
XLogP2.11
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide (CID 3163423) is 2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide is Cc1ccc(S(=O)(=O)CC(=O)Nc2cccc(C)n2)cc1.
What is the InChIKey of 2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide?
The InChIKey is LRDKRTJEUCLYTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c1-11-6-8-13(9-7-11)21(19,20)10-15(18)17-14-5-3-4-12(2)16-14/h3-9H,10H2,1-2H3,(H,16,17,18).
What are the key properties of 2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide?
2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide has a molecular weight of 304.37 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 3163423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).