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

C9H16N2O3S — CID 65110100

IUPACN-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCC(C)(O)CNC(=O)CN1CSCC1=O
InChIInChI=1S/C9H16N2O3S/c1-9(2,14)5-10-7(12)3-11-6-15-4-8(11)13/h14H,3-6H2,1-2H3,(H,10,12)
InChIKeyQDVPCOMNCGXICG-UHFFFAOYSA-N
MW232.30 g/mol
LogP-0.59
Rot. Bonds4

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

N-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 65110100) has the molecular formula C9H16N2O3S and a molecular weight of 232.30 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID65110100
Molecular FormulaC9H16N2O3S
Molecular Weight232.30 g/mol
Exact Mass232.09
IUPAC NameN-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCC(C)(O)CNC(=O)CN1CSCC1=O
InChIInChI=1S/C9H16N2O3S/c1-9(2,14)5-10-7(12)3-11-6-15-4-8(11)13/h14H,3-6H2,1-2H3,(H,10,12)
InChIKeyQDVPCOMNCGXICG-UHFFFAOYSA-N
XLogP-0.59
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.30
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 65110100) is N-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is CC(C)(O)CNC(=O)CN1CSCC1=O.
What is the InChIKey of N-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is QDVPCOMNCGXICG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3S/c1-9(2,14)5-10-7(12)3-11-6-15-4-8(11)13/h14H,3-6H2,1-2H3,(H,10,12).
What are the key properties of N-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 232.30 g/mol, XLogP of -0.59, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 65110100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).