methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate

C13H25NO4Si — CID 11694918

IUPACmethyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate
SMILESCOC(=O)[C@]1(CO[Si](C)(C)C(C)(C)C)CCC(=O)N1
InChIInChI=1S/C13H25NO4Si/c1-12(2,3)19(5,6)18-9-13(11(16)17-4)8-7-10(15)14-13/h7-9H2,1-6H3,(H,14,15)/t13-/m1/s1
InChIKeyCKNGATQRWRDDFC-CYBMUJFWSA-N
MW287.43 g/mol
LogP1.83
Rot. Bonds4

About methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate

methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate (PubChem CID 11694918) has the molecular formula C13H25NO4Si and a molecular weight of 287.43 g/mol. Its IUPAC name is methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate.

Molecular Properties

Compound Namemethyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate
PubChem CID11694918
Molecular FormulaC13H25NO4Si
Molecular Weight287.43 g/mol
Exact Mass287.16
IUPAC Namemethyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate
SMILESCOC(=O)[C@]1(CO[Si](C)(C)C(C)(C)C)CCC(=O)N1
InChIInChI=1S/C13H25NO4Si/c1-12(2,3)19(5,6)18-9-13(11(16)17-4)8-7-10(15)14-13/h7-9H2,1-6H3,(H,14,15)/t13-/m1/s1
InChIKeyCKNGATQRWRDDFC-CYBMUJFWSA-N
XLogP1.83
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.43
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methyl (2S,4S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-methyl-3-methylidene-5-oxopyrrolidine-2-carboxylate
CID 11392848
ethyl 2-ethyl-5-oxopyrrolidine-2-carboxylate
CID 58405373
methyl 1-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-methylcyclobutane-1-carboxylate
CID 174067211
ethyl 3-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopyrrolidine-3-carboxylate
CID 170603681
methyl 5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-hydroxy-5-methylcyclohexene-1-carboxylate
CID 162372938
methyl (2S)-2-formyl-5-oxopyrrolidine-2-carboxylate
CID 130625003
4-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-methylpyrrolidin-2-one
CID 153401151
ethyl (1R)-1-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-methyl-2-oxocyclohex-3-ene-1-carboxylate
CID 57326931
1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclobutan-1-ol
CID 70362766
methyl 2-ethynyl-5-oxopyrrolidine-2-carboxylate
CID 56980346
[1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclopropyl]methanol
CID 59000904
methyl 3-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2,2-dimethylpropanoyloxymethyl)-5-methoxycyclohexa-2,5-diene-1-carboxylate
CID 71544738

Frequently Asked Questions

What is the IUPAC name of methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate?
The IUPAC name of methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate (CID 11694918) is methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate.
What is the SMILES notation for methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate?
The canonical SMILES for methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate is COC(=O)[C@]1(CO[Si](C)(C)C(C)(C)C)CCC(=O)N1.
What is the InChIKey of methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate?
The InChIKey is CKNGATQRWRDDFC-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H25NO4Si/c1-12(2,3)19(5,6)18-9-13(11(16)17-4)8-7-10(15)14-13/h7-9H2,1-6H3,(H,14,15)/t13-/m1/s1.
What are the key properties of methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate?
methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate has a molecular weight of 287.43 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-oxopyrrolidine-2-carboxylate is sourced from PubChem (CID 11694918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).