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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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