N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide

C11H16N2O2S — CID 733883

IUPACN-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide
SMILESCC(=O)c1sc(NC(=O)C(C)(C)C)nc1C
InChIInChI=1S/C11H16N2O2S/c1-6-8(7(2)14)16-10(12-6)13-9(15)11(3,4)5/h1-5H3,(H,12,13,15)
InChIKeyFDOOXGOCOOATEZ-UHFFFAOYSA-N
MW240.33 g/mol
LogP2.64
Rot. Bonds2

About N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide

N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide (PubChem CID 733883) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide
PubChem CID733883
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC NameN-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide
SMILESCC(=O)c1sc(NC(=O)C(C)(C)C)nc1C
InChIInChI=1S/C11H16N2O2S/c1-6-8(7(2)14)16-10(12-6)13-9(15)11(3,4)5/h1-5H3,(H,12,13,15)
InChIKeyFDOOXGOCOOATEZ-UHFFFAOYSA-N
XLogP2.64
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide?
The IUPAC name of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide (CID 733883) is N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide is CC(=O)c1sc(NC(=O)C(C)(C)C)nc1C.
What is the InChIKey of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide?
The InChIKey is FDOOXGOCOOATEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c1-6-8(7(2)14)16-10(12-6)13-9(15)11(3,4)5/h1-5H3,(H,12,13,15).
What are the key properties of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide?
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide has a molecular weight of 240.33 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide is sourced from PubChem (CID 733883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).