tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate

C19H35NO4Si — CID 22670513

IUPACtert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate
SMILESCC[Si](CC)(CC)OC1C(=O)N(C(=O)OC(C)(C)C)C1C1CCCC1
InChIInChI=1S/C19H35NO4Si/c1-7-25(8-2,9-3)24-16-15(14-12-10-11-13-14)20(17(16)21)18(22)23-19(4,5)6/h14-16H,7-13H2,1-6H3
InChIKeyFREIBXUWXJQPDQ-UHFFFAOYSA-N
MW369.58 g/mol
LogP4.71
Rot. Bonds6

About tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate

tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate (PubChem CID 22670513) has the molecular formula C19H35NO4Si and a molecular weight of 369.58 g/mol. Its IUPAC name is tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate
PubChem CID22670513
Molecular FormulaC19H35NO4Si
Molecular Weight369.58 g/mol
Exact Mass369.23
IUPAC Nametert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate
SMILESCC[Si](CC)(CC)OC1C(=O)N(C(=O)OC(C)(C)C)C1C1CCCC1
InChIInChI=1S/C19H35NO4Si/c1-7-25(8-2,9-3)24-16-15(14-12-10-11-13-14)20(17(16)21)18(22)23-19(4,5)6/h14-16H,7-13H2,1-6H3
InChIKeyFREIBXUWXJQPDQ-UHFFFAOYSA-N
XLogP4.71
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.58
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

cyclohexyl 2-cyclohexyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate
CID 22670492
propan-2-yl (2S,3R)-2-cyclohexyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate
CID 54385763
tert-butyl (3R,4S)-2-oxo-4-thiophen-3-yl-3-triethylsilyloxyazetidine-1-carboxylate
CID 54275683
tert-butyl 2-oxo-4-thiophen-3-yl-3-triethylsilyloxyazetidine-1-carboxylate
CID 22670494
tert-butyl 1,3,3a,4,5,6,7,7a-octahydroisoindole-2-carboxylate
CID 73171544
tert-butyl (2R,3S)-2-cyclohexyl-3-(hydroxymethyl)aziridine-1-carboxylate
CID 23660883
tert-butyl 2-cyclohexyl-4,6-dioxopiperidine-1-carboxylate
CID 90871417
tert-butyl (3R,6R)-3,6-dimethyl-2-oxopiperidine-1-carboxylate
CID 11736302
tert-butyl 3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxylate
CID 63788488
tert-butyl (5aR,9aR)-2,3,4,5,5a,6,7,8,9,9a-decahydrobenzo[b]azepine-1-carboxylate
CID 178143547
tert-butyl (3R)-3-cyclopentyl-4-oxopiperidine-1-carboxylate
CID 124601624
tert-butyl 3-ethylazepane-1-carboxylate
CID 118248120

Frequently Asked Questions

What is the IUPAC name of tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate?
The IUPAC name of tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate (CID 22670513) is tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate.
What is the SMILES notation for tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate?
The canonical SMILES for tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate is CC[Si](CC)(CC)OC1C(=O)N(C(=O)OC(C)(C)C)C1C1CCCC1.
What is the InChIKey of tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate?
The InChIKey is FREIBXUWXJQPDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35NO4Si/c1-7-25(8-2,9-3)24-16-15(14-12-10-11-13-14)20(17(16)21)18(22)23-19(4,5)6/h14-16H,7-13H2,1-6H3.
What are the key properties of tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate?
tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate has a molecular weight of 369.58 g/mol, XLogP of 4.71, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 2-cyclopentyl-4-oxo-3-triethylsilyloxyazetidine-1-carboxylate is sourced from PubChem (CID 22670513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).