tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate

C17H33NO4Si — CID 156636364

IUPACtert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1C(=O)CC[C@@H]1CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H33NO4Si/c1-16(2,3)22-15(20)18-13(9-10-14(18)19)11-12-21-23(7,8)17(4,5)6/h13H,9-12H2,1-8H3/t13-/m1/s1
InChIKeyQMXFYCJPLYDLRB-CYBMUJFWSA-N
MW343.54 g/mol
LogP4.32
Rot. Bonds4

About tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate

tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate (PubChem CID 156636364) has the molecular formula C17H33NO4Si and a molecular weight of 343.54 g/mol. Its IUPAC name is tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate
PubChem CID156636364
Molecular FormulaC17H33NO4Si
Molecular Weight343.54 g/mol
Exact Mass343.22
IUPAC Nametert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1C(=O)CC[C@@H]1CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H33NO4Si/c1-16(2,3)22-15(20)18-13(9-10-14(18)19)11-12-21-23(7,8)17(4,5)6/h13H,9-12H2,1-8H3/t13-/m1/s1
InChIKeyQMXFYCJPLYDLRB-CYBMUJFWSA-N
XLogP4.32
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.54
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate?
The IUPAC name of tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate (CID 156636364) is tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate.
What is the SMILES notation for tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate?
The canonical SMILES for tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate is CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1CCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate?
The InChIKey is QMXFYCJPLYDLRB-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H33NO4Si/c1-16(2,3)22-15(20)18-13(9-10-14(18)19)11-12-21-23(7,8)17(4,5)6/h13H,9-12H2,1-8H3/t13-/m1/s1.
What are the key properties of tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate?
tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate has a molecular weight of 343.54 g/mol, XLogP of 4.32, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl (2R)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-1-carboxylate is sourced from PubChem (CID 156636364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).