tert-butyl 2-oxo-7-azaspiro[3.5]nonane-7-carboxylate

tert-butyl 2-oxo-7-azaspiro[3.5]nonane-7-carboxylate

CAS: 203661-69-2

Formula: C13H21NO3

SMILES: CC(C)(C)OC(=O)N1CCC2(CC(=O)C2)CC1

IUPAC: tert-butyl 2-oxo-7-azaspiro[3.5]nonane-7-carboxylate

InChI: InChI=1S/C13H21NO3/c1-12(2,3)17-11(16)14-6-4-13(5-7-14)8-10(15)9-13/h4-9H2,1-3H3

Composition: C (65.25%), H (8.85%), N (5.85%), O (20.06%)

Molar Mass: 239.315

Atom Count: 38

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	239.15214354
Formal Charge	0
FSP3	0.85
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	SIMIIXFMGJYGLR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.29
Topological Polar Surface Area	46.61
Polarizability	25.21
Ring Count	2
Rotatable Bond Count	2

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