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tert-butyl (3aR,5S,6aS)-5-amino-hexahydro-1H-cyclopenta[c]pyrrole-2-carboxylate

tert-butyl (3aR,5S,6aS)-5-amino-hexahydro-1H-cyclopenta[c]pyrrole-2-carboxylate

CAS: 1221439-83-3

Formula: C12H22N2O2

SMILES: [H][C@@]12C[C@@H](N)C[C@]1([H])CN(C2)C(=O)OC(C)(C)C

IUPAC: tert-butyl (3aR,5S,6aS)-5-amino-octahydrocyclopenta[c]pyrrole-2-carboxylate

InChI: InChI=1S/C12H22N2O2/c1-12(2,3)16-11(15)14-6-8-4-10(13)5-9(8)7-14/h8-10H,4-7,13H2,1-3H3/t8-,9+,10-

Composition: C (63.69%), H (9.80%), N (12.38%), O (14.14%)

Molar Mass: 226.32

Atom Count: 38

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 3
Exact Mass 226.168127956
Formal Charge 0
FSP3 0.92
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey DPYIUHWPQGIBSS-MYJAWHEDSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.3
Topological Polar Surface Area 55.56
Polarizability 24.81
Ring Count 2
Rotatable Bond Count 2

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