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tert-butyl N-[(3S)-6-oxopiperidin-3-yl]carbamate

tert-butyl N-[(3S)-6-oxopiperidin-3-yl]carbamate

CAS: 172913-96-1

Formula: C10H18N2O3

SMILES: CC(C)(C)OC(=O)N[C@H]1CCC(=O)NC1

IUPAC: tert-butyl N-[(3S)-6-oxopiperidin-3-yl]carbamate

InChI: InChI=1S/C10H18N2O3/c1-10(2,3)15-9(14)12-7-4-5-8(13)11-6-7/h7H,4-6H2,1-3H3,(H,11,13)(H,12,14)/t7-/m0/s1

Composition: C (56.06%), H (8.47%), N (13.07%), O (22.40%)

Molar Mass: 214.265

Atom Count: 33

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 214.131742448
Formal Charge 0
FSP3 0.8
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey KBNSUMIBERIFIT-ZETCQYMHSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.75
Topological Polar Surface Area 67.43
Polarizability 21.59
Ring Count 1
Rotatable Bond Count 3

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