1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione

C17H27NO2Si2 — CID 10544651

IUPAC1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione
SMILESC[Si](C)(C)C1C(=O)N(Cc2ccccc2)C(=O)C1[Si](C)(C)C
InChIInChI=1S/C17H27NO2Si2/c1-21(2,3)14-15(22(4,5)6)17(20)18(16(14)19)12-13-10-8-7-9-11-13/h7-11,14-15H,12H2,1-6H3
InChIKeyOBFWSKNIZDEVPV-UHFFFAOYSA-N
MW333.58 g/mol
LogP3.97
Rot. Bonds4

About 1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione

1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione (PubChem CID 10544651) has the molecular formula C17H27NO2Si2 and a molecular weight of 333.58 g/mol. Its IUPAC name is 1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione
PubChem CID10544651
Molecular FormulaC17H27NO2Si2
Molecular Weight333.58 g/mol
Exact Mass333.16
IUPAC Name1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione
SMILESC[Si](C)(C)C1C(=O)N(Cc2ccccc2)C(=O)C1[Si](C)(C)C
InChIInChI=1S/C17H27NO2Si2/c1-21(2,3)14-15(22(4,5)6)17(20)18(16(14)19)12-13-10-8-7-9-11-13/h7-11,14-15H,12H2,1-6H3
InChIKeyOBFWSKNIZDEVPV-UHFFFAOYSA-N
XLogP3.97
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.58
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione with MolForge

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

Launch Full Analysis

Related Compounds

(3R,4R)-1-benzyl-3,4-dihydroxypyrrolidine-2,5-dione
CID 729946
(3aS,7aR)-2-benzyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
CID 795274
(3S,4S)-1-benzyl-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]pyrrolidine-2,5-dione
CID 11102405
(3aR,4R,7S,7aR)-2-benzyl-4,7-dimethyl-3a,7a-dihydro-4,7-epoxyisoindole-1,3-dione
CID 124910195
(3aR,4R,7R,7aS)-2-benzyl-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione
CID 99173411
(1S,5S)-3-benzyl-8-methyl-3,8-diazabicyclo[3.2.1]octane-2,4-dione
CID 98056412
3-benzyl-6-methyl-2,4-dioxo-3-azabicyclo[3.1.0]hexane-6-carboxylic acid
CID 82380265
(3aR,4S,7S,7aR)-2-benzyl-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
CID 99734182
(3aS,6aR)-5-benzyl-2,3,3a,6a-tetrahydrofuro[2,3-c]pyrrole-4,6-dione
CID 139215242
methyl 3-benzyl-2,4-dioxo-3-azabicyclo[3.1.0]hexane-6-carboxylate
CID 134346997
(1S,5S)-3-benzyl-6-nitro-3-azabicyclo[3.1.0]hexane-2,4-dione
CID 98176114
(1R,2S,3S,7R,8R,9S,10R,14S)-5,12-dibenzyl-5,12-diazapentacyclo[7.5.2.02,8.03,7.010,14]hexadec-15-ene-4,6,11,13-tetrone
CID 124717285

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione?
The IUPAC name of 1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione (CID 10544651) is 1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione?
The canonical SMILES for 1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione is C[Si](C)(C)C1C(=O)N(Cc2ccccc2)C(=O)C1[Si](C)(C)C.
What is the InChIKey of 1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione?
The InChIKey is OBFWSKNIZDEVPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2Si2/c1-21(2,3)14-15(22(4,5)6)17(20)18(16(14)19)12-13-10-8-7-9-11-13/h7-11,14-15H,12H2,1-6H3.
What are the key properties of 1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione?
1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione has a molecular weight of 333.58 g/mol, XLogP of 3.97, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3,4-bis(trimethylsilyl)pyrrolidine-2,5-dione is sourced from PubChem (CID 10544651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).