N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide

C11H20N2O2S — CID 3527737

IUPACN-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide
SMILESCCC(CC)C1SCC(=O)N1CC(=O)NC
InChIInChI=1S/C11H20N2O2S/c1-4-8(5-2)11-13(6-9(14)12-3)10(15)7-16-11/h8,11H,4-7H2,1-3H3,(H,12,14)
InChIKeyALWYLPUKQCWZIL-UHFFFAOYSA-N
MW244.36 g/mol
LogP1.07
Rot. Bonds5

About N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide

N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide (PubChem CID 3527737) has the molecular formula C11H20N2O2S and a molecular weight of 244.36 g/mol. Its IUPAC name is N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide
PubChem CID3527737
Molecular FormulaC11H20N2O2S
Molecular Weight244.36 g/mol
Exact Mass244.12
IUPAC NameN-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide
SMILESCCC(CC)C1SCC(=O)N1CC(=O)NC
InChIInChI=1S/C11H20N2O2S/c1-4-8(5-2)11-13(6-9(14)12-3)10(15)7-16-11/h8,11H,4-7H2,1-3H3,(H,12,14)
InChIKeyALWYLPUKQCWZIL-UHFFFAOYSA-N
XLogP1.07
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide (CID 3527737) is N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide is CCC(CC)C1SCC(=O)N1CC(=O)NC.
What is the InChIKey of N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is ALWYLPUKQCWZIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2S/c1-4-8(5-2)11-13(6-9(14)12-3)10(15)7-16-11/h8,11H,4-7H2,1-3H3,(H,12,14).
What are the key properties of N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide?
N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 244.36 g/mol, XLogP of 1.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-oxo-2-pentan-3-yl-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 3527737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).