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    Chemistry

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    Also known as: Lpm7gsn5kn, 2628280-48-6, (2s)-2-amino-3-[(3s)-2-oxopyrrolidin-3-yl]propanamide hydrochloride, 3-pyrrolidinepropanamide, alpha-amino-2-oxo-, hydrochloride (1:1), (alphas,3s)-, (2s)-2-amino-3-((3s)-2-oxopyrrolidin-3-yl)propanamide hydrochloride, Unii-lpm7gsn5kn
    Molecular Formula
    C7H14ClN3O2
    Molecular Weight
    207.66  g/mol
    InChI Key
    XMKRXOFRYITIKH-FHAQVOQBSA-N
    FDA UNII
    LPM7GSN5KN
    CAS 2628280-48-6
    1 2D Structure

    CAS 2628280-48-6

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2S)-2-amino-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide;hydrochloride
    2.1.2 InChI
    InChI=1S/C7H13N3O2.ClH/c8-5(6(9)11)3-4-1-2-10-7(4)12;/h4-5H,1-3,8H2,(H2,9,11)(H,10,12);1H/t4-,5-;/m0./s1
    2.1.3 InChI Key
    XMKRXOFRYITIKH-FHAQVOQBSA-N
    2.1.4 Canonical SMILES
    C1CNC(=O)C1CC(C(=O)N)N.Cl
    2.1.5 Isomeric SMILES
    C1CNC(=O)[C@@H]1C[C@@H](C(=O)N)N.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    LPM7GSN5KN
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Lpm7gsn5kn

    2. 2628280-48-6

    3. (2s)-2-amino-3-[(3s)-2-oxopyrrolidin-3-yl]propanamide Hydrochloride

    4. 3-pyrrolidinepropanamide, Alpha-amino-2-oxo-, Hydrochloride (1:1), (alphas,3s)-

    5. (2s)-2-amino-3-((3s)-2-oxopyrrolidin-3-yl)propanamide Hydrochloride

    6. Unii-lpm7gsn5kn

    7. At31700

    8. Cs-0372248

    2.4 Create Date
    2021-12-15
    3 Chemical and Physical Properties
    Molecular Weight 207.66 g/mol
    Molecular Formula C7H14ClN3O2
    Hydrogen Bond Donor Count4
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count3
    Exact Mass207.0774544 g/mol
    Monoisotopic Mass207.0774544 g/mol
    Topological Polar Surface Area98.2 Ų
    Heavy Atom Count13
    Formal Charge0
    Complexity205
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2

    BUILDING BLOCK

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