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

C12H19N3O3S — CID 47116849

IUPACN-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCC(=O)N1CCC(NC(=O)CN2CSCC2=O)CC1
InChIInChI=1S/C12H19N3O3S/c1-9(16)14-4-2-10(3-5-14)13-11(17)6-15-8-19-7-12(15)18/h10H,2-8H2,1H3,(H,13,17)
InChIKeyRXSSTTWFLLRMNW-UHFFFAOYSA-N
MW285.37 g/mol
LogP-0.35
Rot. Bonds3

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

N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 47116849) has the molecular formula C12H19N3O3S and a molecular weight of 285.37 g/mol. Its IUPAC name is N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID47116849
Molecular FormulaC12H19N3O3S
Molecular Weight285.37 g/mol
Exact Mass285.11
IUPAC NameN-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCC(=O)N1CCC(NC(=O)CN2CSCC2=O)CC1
InChIInChI=1S/C12H19N3O3S/c1-9(16)14-4-2-10(3-5-14)13-11(17)6-15-8-19-7-12(15)18/h10H,2-8H2,1H3,(H,13,17)
InChIKeyRXSSTTWFLLRMNW-UHFFFAOYSA-N
XLogP-0.35
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 5-0.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 47341054
N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 119478713
N-(3-methylcyclopentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 114549925
2-(4-oxo-1,3-thiazolidin-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 47019402
N-(2-methylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide;hydrochloride
CID 120600156
N'-[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]cyclopropanecarbohydrazide
CID 51110368
N-[(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 100851674
2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid
CID 43360305
N-[2-(cycloheptylamino)ethyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide;hydrochloride
CID 119621270
2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]acetic acid
CID 43170515
ethyl 4-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]piperidine-1-carboxylate
CID 110689912
N-(2-cyclopropyl-2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 63295069

Frequently Asked Questions

What is the IUPAC name of N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 47116849) is N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is CC(=O)N1CCC(NC(=O)CN2CSCC2=O)CC1.
What is the InChIKey of N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is RXSSTTWFLLRMNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3S/c1-9(16)14-4-2-10(3-5-14)13-11(17)6-15-8-19-7-12(15)18/h10H,2-8H2,1H3,(H,13,17).
What are the key properties of N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 285.37 g/mol, XLogP of -0.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 47116849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).