(2S)-2-[(2-methoxybenzylamino)methyl]pyrrolidine-1-carboxylic acid benzyl ester

HCID 69745936
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Basic information

Standard SMILES
COc1ccccc1CNC[C@@H]1CCCN1C(=O)OCc1ccccc1
InChIKey
AHFQAYLDTNNPGB-IBGZPJMESA-N
Molecular formula
C21H26N2O3
Average molar mass
354.4 g/mol

Names & identifiers

Preferred name
(2S)-2-[(2-methoxybenzylamino)methyl]pyrrolidine-1-carboxylic acid benzyl ester
IUPAC
benzyl (2S)-2-[[(2-methoxyphenyl)methylamino]methyl]pyrrolidine-1-carboxylate

Names & synonyms

SCHEMBL6337611AHFQAYLDTNNPGB-IBGZPJMESA-N(2S)-2-[(2-methoxybenzylamino) methyl]-pyrrolidine-1-carboxylic acid benzyl ester(2S)-2-[(2-methoxybenzylamino)methyl]-pyrrolidine-1-carboxylic acid benzyl ester(2S)-2-[(2-methoxybenzylamino)methyl]pyrrolidine-1-carboxylic acid benzyl ester

Database identifiers

PubChem CID
69745936

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
50.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
26

Related reactions

2 records
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Compound notes

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