tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate

C30H43NO4Si — CID 11577087

IUPACtert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate
SMILESCC(C)C[C@@H]1CC(=O)N(C(=O)OC(C)(C)C)[C@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C30H43NO4Si/c1-22(2)19-23-20-27(32)31(28(33)35-29(3,4)5)26(23)21-34-36(30(6,7)8,24-15-11-9-12-16-24)25-17-13-10-14-18-25/h9-18,22-23,26H,19-21H2,1-8H3/t23-,26+/m1/s1
InChIKeyZYAPSFJYWWVNJJ-BVAGGSTKSA-N
MW509.76 g/mol
LogP5.76
Rot. Bonds7

About tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate

tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate (PubChem CID 11577087) has the molecular formula C30H43NO4Si and a molecular weight of 509.76 g/mol. Its IUPAC name is tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate
PubChem CID11577087
Molecular FormulaC30H43NO4Si
Molecular Weight509.76 g/mol
Exact Mass509.30
IUPAC Nametert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate
SMILESCC(C)C[C@@H]1CC(=O)N(C(=O)OC(C)(C)C)[C@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C30H43NO4Si/c1-22(2)19-23-20-27(32)31(28(33)35-29(3,4)5)26(23)21-34-36(30(6,7)8,24-15-11-9-12-16-24)25-17-13-10-14-18-25/h9-18,22-23,26H,19-21H2,1-8H3/t23-,26+/m1/s1
InChIKeyZYAPSFJYWWVNJJ-BVAGGSTKSA-N
XLogP5.76
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500509.76
LogP ≤ 55.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-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,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate?
The IUPAC name of tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate (CID 11577087) is tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate.
What is the SMILES notation for tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate?
The canonical SMILES for tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate is CC(C)C[C@@H]1CC(=O)N(C(=O)OC(C)(C)C)[C@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate?
The InChIKey is ZYAPSFJYWWVNJJ-BVAGGSTKSA-N. The full InChI is InChI=1S/C30H43NO4Si/c1-22(2)19-23-20-27(32)31(28(33)35-29(3,4)5)26(23)21-34-36(30(6,7)8,24-15-11-9-12-16-24)25-17-13-10-14-18-25/h9-18,22-23,26H,19-21H2,1-8H3/t23-,26+/m1/s1.
What are the key properties of tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate?
tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate has a molecular weight of 509.76 g/mol, XLogP of 5.76, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl (2R,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-(2-methylpropyl)-5-oxopyrrolidine-1-carboxylate is sourced from PubChem (CID 11577087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).