rel-(3R,4S)-tert-Butyl 3-acetamido-4-allyl-3-(tert-butylcarbamoyl)pyrrolidine-1-carboxylate

HCID 69669632

Basic information

Standard SMILES
C=CC[C@H]1CN(C(=O)OC(C)(C)C)C[C@@]1(NC(C)=O)C(=O)NC(C)(C)C
InChIKey
PSNFRMXIQNDKLS-LIRRHRJNSA-N
Molecular formula
C19H33N3O4
Average molar mass
367.5 g/mol
Monoisotopic mass
367.24710654

Names & identifiers

Preferred name
rel-(3R,4S)-tert-Butyl 3-acetamido-4-allyl-3-(tert-butylcarbamoyl)pyrrolidine-1-carboxylate
IUPAC
tert-butyl (3R,4S)-3-acetamido-3-(tert-butylcarbamoyl)-4-prop-2-enylpyrrolidine-1-carboxylate

Names & synonyms

1374334-12-9rel-(3R,4S)-tert-Butyl 3-acetamido-4-allyl-3-(tert-butylcarbamoyl)pyrrolidine-1-carboxylate(3R,4S)-tert-butyl 3-acetamido-4-allyl-3-(tert-butylcarbamoyl)pyrrolidine-1-carboxylatetert-butyl (3R,4S)-3-acetamido-4-allyl-3-(tert-butylcarbamoyl)pyrrolidine-1-carboxylateSCHEMBL6114151PSNFRMXIQNDKLS-LIRRHRJNSA-NMFCD34602163BS-45257F72279rel-(3R,4S)-tert-Butyl3-acetamido-4-allyl-3-(tert-butylcarbamoyl)pyrrolidine-1-carboxylate1-Pyrrolidinecarboxylic acid, 3-(acetylamino)-3-[[(1,1-dimethylethyl)amino]carbonyl]-4-(2-propen-1-yl)-, 1,1-dimethylethyl ester, (3R,4S)-rel-tert-butyl (3R,4S)-3-acetamido-3-(tert-butylcarbamoyl)-4-prop-2-enylpyrrolidine-1-carboxylate

Database identifiers

PubChem CID
69669632

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
87.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
26

Related reactions

4 records

Linked notes

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