Ketcher 04072110172D 1   1.00000     0.00000     0

  5  5  0     0  0            999 V2000
   -0.8089   -0.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5000   -1.5389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5000   -1.5389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8090   -0.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  5  1  1  0     0  0
  5  4  1  0     0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
M  END
> <ID>
CHEBI:33135

> <NAME>
pyrrolidine

> <DEFINITION>
A cyclic amine whose five-membered ring contains four carbon atoms and one nitrogen atom; the parent compound of the pyrrolidine family.

> <STAR>
3

> <SYNONYM>
tetramethylenimine; tetrahydropyrrole; prolamine; perhydropyrrole; butylenimine; azolidine; azacyclopentane; 1-azacyclopentane

> <IUPAC_NAME>
pyrrolidine

> <FORMULA>
C4H9N

> <MASS>
71.123

> <MONOISOTOPIC_MASS>
71.07350

> <CHARGE>
0

> <SMILES>
C1CCNC1

> <INCHI>
InChI=1S/C4H9N/c1-2-4-5-3-1/h5H,1-4H2

> <INCHIKEY>
RWRDLPDLKQPQOW-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
102395

> <CAS_REGISTRY_NUMBER>
123-75-1

> <GMELIN_REGISTRY_NUMBER>
1704

> <CHEMIDPLUS>
123-75-1

> <NIST_CHEMISTRY_WEBBOOK>
123-75-1

> <PDBECHEM_ACCESSION>
VES

> <PUBMED_CITATION>
1221030; 18838771; 20024446

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