benzyl 2-oxo-7-azaspiro[3.5]nonane-7-carboxylate

benzyl 2-oxo-7-azaspiro[3.5]nonane-7-carboxylate

CAS: 147610-98-8

Formula: C16H19NO3

SMILES: O=C(OCC1=CC=CC=C1)N1CCC2(CC(=O)C2)CC1

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

InChI: InChI=1S/C16H19NO3/c18-14-10-16(11-14)6-8-17(9-7-16)15(19)20-12-13-4-2-1-3-5-13/h1-5H,6-12H2

Composition: C (70.31%), H (7.01%), N (5.12%), O (17.56%)

Molar Mass: 273.332

Atom Count: 39

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	273.136493476
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	RPSFFDLCJFAYIP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.1
Topological Polar Surface Area	46.61
Polarizability	29.26
Ring Count	3
Rotatable Bond Count	3

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