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Compound
tert-butyl N-(1-tert-butyl-5-carbamoylpyrrolidin-3-yl)carbamate
HCID
178452800
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
CC(C)(C)OC(=O)NC1CC(C(N)=O)N(C(C)(C)C)C1
InChIKey
FIUBTMPVEUFHAG-UHFFFAOYSA-N
Molecular formula
C14H27N3O3
Average molar mass
285.38 g/mol
Monoisotopic mass
285.20524173
Names & identifiers
IUPAC
tert-butyl N-(1-tert-butyl-5-carbamoylpyrrolidin-3-yl)carbamate
Database identifiers
PubChem CID
76501729
Properties
Computed structural properties
XLogP
1.1
Topological polar surface area
84.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
20
Formal charge
0
Complexity
382
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
187617
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID
295990
As product
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Compound notes
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