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

C14H25N3O2S — CID 47341054

IUPACN-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCC(C)(C)N1CCC(NC(=O)CN2CSCC2=O)CC1
InChIInChI=1S/C14H25N3O2S/c1-14(2,3)17-6-4-11(5-7-17)15-12(18)8-16-10-20-9-13(16)19/h11H,4-10H2,1-3H3,(H,15,18)
InChIKeyMYZGOVSZFONWAP-UHFFFAOYSA-N
MW299.44 g/mol
LogP0.90
Rot. Bonds3

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

N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 47341054) has the molecular formula C14H25N3O2S and a molecular weight of 299.44 g/mol. Its IUPAC name is N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID47341054
Molecular FormulaC14H25N3O2S
Molecular Weight299.44 g/mol
Exact Mass299.17
IUPAC NameN-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCC(C)(C)N1CCC(NC(=O)CN2CSCC2=O)CC1
InChIInChI=1S/C14H25N3O2S/c1-14(2,3)17-6-4-11(5-7-17)15-12(18)8-16-10-20-9-13(16)19/h11H,4-10H2,1-3H3,(H,15,18)
InChIKeyMYZGOVSZFONWAP-UHFFFAOYSA-N
XLogP0.90
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.44
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 47116849
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
2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid
CID 43360305
N'-[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]cyclopropanecarbohydrazide
CID 51110368
N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 64556996
N-[(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 100851674
N-(1-tert-butylpiperidin-4-yl)-5-hydroxypentanamide
CID 79199518
N-[2-(cycloheptylamino)ethyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide;hydrochloride
CID 119621270
2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide
CID 61264639

Frequently Asked Questions

What is the IUPAC name of N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 47341054) is N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is CC(C)(C)N1CCC(NC(=O)CN2CSCC2=O)CC1.
What is the InChIKey of N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is MYZGOVSZFONWAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2S/c1-14(2,3)17-6-4-11(5-7-17)15-12(18)8-16-10-20-9-13(16)19/h11H,4-10H2,1-3H3,(H,15,18).
What are the key properties of N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 299.44 g/mol, XLogP of 0.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 47341054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).