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1-Pyrrolidinamine

PubChem CID: 27946

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Compound Synonyms 1-Aminopyrrolidine, pyrrolidin-1-amine, 16596-41-1, 1-Pyrrolidinamine, N-Aminopyrrolidine, Pyrrolidine, 1-amino-, aminopyrrolidine, pyrrolidin-1-ylamine, pyrrolidylamine, DF424U7HM6, NSC 80647, NSC-80647, DTXSID40168052, MFCD07368381, NSC80647, 1-Aminopyrrolidine?, Pyrrolidine, 1amino, UNII-DF424U7HM6, DTXCID5090543, ALBB-032445, AKOS003582850, SY235166, DB-005671, P2560, EN300-201007, F13227, A810683, 630-631-2
Topological Polar Surface Area 29.3
Hydrogen Bond Donor Count 1.0
Heavy Atom Count 6.0
Isotope Atom Count 0.0
Molecular Complexity 38.8
Database Name cmaup_ingredients;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name pyrrolidin-1-amine
Prediction Hob 1.0
Xlogp -0.6
Molecular Formula C4H10N2
Prediction Swissadme 0.0
Inchi Key SBMSLRMNBSMKQC-UHFFFAOYSA-N
Fcsp3 1.0
Logs -3.397
Rotatable Bond Count 0.0
Logd 4.174
Compound Name 1-Pyrrolidinamine
Prediction Hob Swissadme 0.0
Exact Mass 86.0844
Formal Charge 0.0
Monoisotopic Mass 86.0844
Hydrogen Bond Acceptor Count 2.0
Molecular Weight 86.14
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Esol 0.02914440000000007
Inchi InChI=1S/C4H10N2/c5-6-3-1-2-4-6/h1-5H2
Smiles C1CCN(C1)N
Nring 2.0
Defined Bond Stereocenter Count 0.0

  • 1. Outgoing r'ship FOUND_IN to/from Ziziphus Jujuba (Plant) Rel Props:Source_db:cmaup_ingredients