tert-butyl 2,3-dihydro-1H-spiro[isoquinoline-4,4'-piperidine]-1'-carboxylate

tert-butyl 2,3-dihydro-1H-spiro[isoquinoline-4,4'-piperidine]-1'-carboxylate

CAS: 159634-80-7

Formula: C18H26N2O2

SMILES: CC(C)(C)OC(=O)N1CCC2(CC1)CNCC1=C2C=CC=C1

IUPAC: tert-butyl 2,3-dihydro-1H-spiro[isoquinoline-4,4'-piperidine]-1'-carboxylate

InChI: InChI=1S/C18H26N2O2/c1-17(2,3)22-16(21)20-10-8-18(9-11-20)13-19-12-14-6-4-5-7-15(14)18/h4-7,19H,8-13H2,1-3H3

Composition: C (71.49%), H (8.67%), N (9.26%), O (10.58%)

Molar Mass: 302.418

Atom Count: 48

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	302.199428085
Formal Charge	0
FSP3	0.61
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	MHALRZHJLIMHKE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	87.71
Topological Polar Surface Area	41.57
Polarizability	34.39
Ring Count	3
Rotatable Bond Count	2

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