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tert-butyl (2R)-2-(aminomethyl)-2-ethylpyrrolidine-1-carboxylate

tert-butyl (2R)-2-(aminomethyl)-2-ethylpyrrolidine-1-carboxylate

CAS: 1630815-53-0

Formula: C12H24N2O2

SMILES: CC[C@]1(CN)CCCN1C(=O)OC(C)(C)C

IUPAC: tert-butyl (2R)-2-(aminomethyl)-2-ethylpyrrolidine-1-carboxylate

InChI: InChI=1S/C12H24N2O2/c1-5-12(9-13)7-6-8-14(12)10(15)16-11(2,3)4/h5-9,13H2,1-4H3/t12-/m0/s1

Composition: C (63.12%), H (10.59%), N (12.27%), O (14.01%)

Molar Mass: 228.336

Atom Count: 40

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 228.183778021
Formal Charge 0
FSP3 0.92
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey ZYKIXJFPSFUIRP-GFCCVEGCSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.01
Topological Polar Surface Area 55.56
Polarizability 25.53
Ring Count 1
Rotatable Bond Count 4

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