2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide

C10H15N3O3S — CID 47351627

IUPAC2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide
SMILESCc1ccnc(NC(=O)CN(C)S(C)(=O)=O)c1
InChIInChI=1S/C10H15N3O3S/c1-8-4-5-11-9(6-8)12-10(14)7-13(2)17(3,15)16/h4-6H,7H2,1-3H3,(H,11,12,14)
InChIKeyZDUKNEWNWPQHNS-UHFFFAOYSA-N
MW257.31 g/mol
LogP0.22
Rot. Bonds4

About 2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide

2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide (PubChem CID 47351627) has the molecular formula C10H15N3O3S and a molecular weight of 257.31 g/mol. Its IUPAC name is 2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide
PubChem CID47351627
Molecular FormulaC10H15N3O3S
Molecular Weight257.31 g/mol
Exact Mass257.08
IUPAC Name2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide
SMILESCc1ccnc(NC(=O)CN(C)S(C)(=O)=O)c1
InChIInChI=1S/C10H15N3O3S/c1-8-4-5-11-9(6-8)12-10(14)7-13(2)17(3,15)16/h4-6H,7H2,1-3H3,(H,11,12,14)
InChIKeyZDUKNEWNWPQHNS-UHFFFAOYSA-N
XLogP0.22
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide (CID 47351627) is 2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide is Cc1ccnc(NC(=O)CN(C)S(C)(=O)=O)c1.
What is the InChIKey of 2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide?
The InChIKey is ZDUKNEWNWPQHNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3S/c1-8-4-5-11-9(6-8)12-10(14)7-13(2)17(3,15)16/h4-6H,7H2,1-3H3,(H,11,12,14).
What are the key properties of 2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide?
2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide has a molecular weight of 257.31 g/mol, XLogP of 0.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 47351627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).