Summary

IMPPAT Phytochemical identifier: IMPHY003499

Phytochemical name: Pyrrolidine

Synonymous chemical names:
prolamin, prolamine, prolamines, pyrrolidine, pyrrolidine ring, pyrrollidine

External chemical identifiers:
CID:31268, ChEMBL:CHEMBL22830, ChEBI:33135, ZINC:ZINC000001690615, FDASRS:LJU5627FYV, SureChEMBL:SCHEMBL2561, MolPort-000-871-501

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Chemical structure information

SMILES:
C1CCCN1

InChI:
InChI=1S/C4H9N/c1-2-4-5-3-1/h5H,1-4H2

InChIKey:
RWRDLPDLKQPQOW-UHFFFAOYSA-N

DeepSMILES:
CCCCN5

Functional groups:
CNC

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCNC1

Scaffold Graph/Node level:
C1CCNC1

Scaffold Graph level:
C1CCCC1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Pyrrolidines

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Lysine alkaloids

NP-Likeness score: 0.195

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Chemical structure download