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

C10H18N2O3S — CID 64556996

IUPACN-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCCC(C)(CO)NC(=O)CN1CSCC1=O
InChIInChI=1S/C10H18N2O3S/c1-3-10(2,6-13)11-8(14)4-12-7-16-5-9(12)15/h13H,3-7H2,1-2H3,(H,11,14)
InChIKeyYZKXMWSXIFIPRY-UHFFFAOYSA-N
MW246.33 g/mol
LogP-0.20
Rot. Bonds5

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

N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 64556996) has the molecular formula C10H18N2O3S and a molecular weight of 246.33 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID64556996
Molecular FormulaC10H18N2O3S
Molecular Weight246.33 g/mol
Exact Mass246.10
IUPAC NameN-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCCC(C)(CO)NC(=O)CN1CSCC1=O
InChIInChI=1S/C10H18N2O3S/c1-3-10(2,6-13)11-8(14)4-12-7-16-5-9(12)15/h13H,3-7H2,1-2H3,(H,11,14)
InChIKeyYZKXMWSXIFIPRY-UHFFFAOYSA-N
XLogP-0.20
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.33
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 64556996) is N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is CCC(C)(CO)NC(=O)CN1CSCC1=O.
What is the InChIKey of N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is YZKXMWSXIFIPRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3S/c1-3-10(2,6-13)11-8(14)4-12-7-16-5-9(12)15/h13H,3-7H2,1-2H3,(H,11,14).
What are the key properties of N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 246.33 g/mol, XLogP of -0.20, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 64556996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).