2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide

C13H26N2OS — CID 67885295

IUPAC2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide
SMILESCC1(C)SC(C)(C)N(C(C)(C)C)[C@@H]1CC(N)=O
InChIInChI=1S/C13H26N2OS/c1-11(2,3)15-9(8-10(14)16)12(4,5)17-13(15,6)7/h9H,8H2,1-7H3,(H2,14,16)/t9-/m1/s1
InChIKeyKDXBBFZTNQORSG-SECBINFHSA-N
MW258.43 g/mol
LogP2.59
Rot. Bonds2

About 2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide

2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide (PubChem CID 67885295) has the molecular formula C13H26N2OS and a molecular weight of 258.43 g/mol. Its IUPAC name is 2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide
PubChem CID67885295
Molecular FormulaC13H26N2OS
Molecular Weight258.43 g/mol
Exact Mass258.18
IUPAC Name2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide
SMILESCC1(C)SC(C)(C)N(C(C)(C)C)[C@@H]1CC(N)=O
InChIInChI=1S/C13H26N2OS/c1-11(2,3)15-9(8-10(14)16)12(4,5)17-13(15,6)7/h9H,8H2,1-7H3,(H2,14,16)/t9-/m1/s1
InChIKeyKDXBBFZTNQORSG-SECBINFHSA-N
XLogP2.59
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.43
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide?
The IUPAC name of 2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide (CID 67885295) is 2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide.
What is the SMILES notation for 2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide?
The canonical SMILES for 2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide is CC1(C)SC(C)(C)N(C(C)(C)C)[C@@H]1CC(N)=O.
What is the InChIKey of 2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide?
The InChIKey is KDXBBFZTNQORSG-SECBINFHSA-N. The full InChI is InChI=1S/C13H26N2OS/c1-11(2,3)15-9(8-10(14)16)12(4,5)17-13(15,6)7/h9H,8H2,1-7H3,(H2,14,16)/t9-/m1/s1.
What are the key properties of 2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide?
2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide has a molecular weight of 258.43 g/mol, XLogP of 2.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4R)-3-tert-butyl-2,2,5,5-tetramethyl-1,3-thiazolidin-4-yl]acetamide is sourced from PubChem (CID 67885295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).