tert-butyl 2-methyl-5-phenylpiperazine-1-carboxylate

tert-butyl 2-methyl-5-phenylpiperazine-1-carboxylate

CAS: 904816-67-7

Formula: C16H24N2O2

SMILES: CC1CNC(CN1C(=O)OC(C)(C)C)C1=CC=CC=C1

IUPAC: tert-butyl 2-methyl-5-phenylpiperazine-1-carboxylate

InChI: InChI=1/C16H24N2O2/c1-12-10-17-14(13-8-6-5-7-9-13)11-18(12)15(19)20-16(2,3)4/h5-9,12,14,17H,10-11H2,1-4H3

Composition: C (69.53%), H (8.75%), N (10.14%), O (11.58%)

Molar Mass: 276.38

Atom Count: 44

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	276.183778021
Formal Charge	0
FSP3	0.56
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	JCGKNAFPLNQLDQ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	79.15
Topological Polar Surface Area	41.57
Polarizability	31.44
Ring Count	2
Rotatable Bond Count	3

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