benzyl 2,6-diazaspiro[3.4]octane-6-carboxylate

benzyl 2,6-diazaspiro[3.4]octane-6-carboxylate

CAS: 1086394-85-5

Formula: C14H18N2O2

SMILES: O=C(OCC1=CC=CC=C1)N1CCC2(CNC2)C1

IUPAC: benzyl 2,6-diazaspiro[3.4]octane-6-carboxylate

InChI: InChI=1S/C14H18N2O2/c17-13(18-8-12-4-2-1-3-5-12)16-7-6-14(11-16)9-15-10-14/h1-5,15H,6-11H2

Composition: C (68.27%), H (7.37%), N (11.37%), O (12.99%)

Molar Mass: 246.31

Atom Count: 36

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	246.136827828
Formal Charge	0
FSP3	0.5
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	UJALRZQHRXFXRD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.63
Topological Polar Surface Area	41.57
Polarizability	27.02
Ring Count	3
Rotatable Bond Count	3

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