tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate

C24H44N2O6Si — CID 19918223

IUPACtert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CC(C2CC(O[Si](C)(C)C(C)(C)C)CN2C(=O)OC(C)(C)C)CC1=O
InChIInChI=1S/C24H44N2O6Si/c1-22(2,3)30-20(28)25-15-17(32-33(10,11)24(7,8)9)13-18(25)16-12-19(27)26(14-16)21(29)31-23(4,5)6/h16-18H,12-15H2,1-11H3
InChIKeyRZKYACHPGAHXSQ-UHFFFAOYSA-N
MW484.71 g/mol
LogP5.17
Rot. Bonds3

About tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate

tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate (PubChem CID 19918223) has the molecular formula C24H44N2O6Si and a molecular weight of 484.71 g/mol. Its IUPAC name is tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate
PubChem CID19918223
Molecular FormulaC24H44N2O6Si
Molecular Weight484.71 g/mol
Exact Mass484.30
IUPAC Nametert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CC(C2CC(O[Si](C)(C)C(C)(C)C)CN2C(=O)OC(C)(C)C)CC1=O
InChIInChI=1S/C24H44N2O6Si/c1-22(2,3)30-20(28)25-15-17(32-33(10,11)24(7,8)9)13-18(25)16-12-19(27)26(14-16)21(29)31-23(4,5)6/h16-18H,12-15H2,1-11H3
InChIKeyRZKYACHPGAHXSQ-UHFFFAOYSA-N
XLogP5.17
TPSA85.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.71
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-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 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate?
The IUPAC name of tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate (CID 19918223) is tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate.
What is the SMILES notation for tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate?
The canonical SMILES for tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate is CC(C)(C)OC(=O)N1CC(C2CC(O[Si](C)(C)C(C)(C)C)CN2C(=O)OC(C)(C)C)CC1=O.
What is the InChIKey of tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate?
The InChIKey is RZKYACHPGAHXSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H44N2O6Si/c1-22(2,3)30-20(28)25-15-17(32-33(10,11)24(7,8)9)13-18(25)16-12-19(27)26(14-16)21(29)31-23(4,5)6/h16-18H,12-15H2,1-11H3.
What are the key properties of tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate?
tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate has a molecular weight of 484.71 g/mol, XLogP of 5.17, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-[4-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-2-oxopyrrolidine-1-carboxylate is sourced from PubChem (CID 19918223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).