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tert-butyl 2-methyl-4-[1-(pyridin-2-yl)ethyl]piperazine-1-carboxylate

tert-butyl 2-methyl-4-[1-(pyridin-2-yl)ethyl]piperazine-1-carboxylate

CAS: 1289386-27-1

Formula: C17H27N3O2

SMILES: CC(N1CCN(C(C)C1)C(=O)OC(C)(C)C)C1=CC=CC=N1

IUPAC: tert-butyl 2-methyl-4-[1-(pyridin-2-yl)ethyl]piperazine-1-carboxylate

InChI: InChI=1/C17H27N3O2/c1-13-12-19(14(2)15-8-6-7-9-18-15)10-11-20(13)16(21)22-17(3,4)5/h6-9,13-14H,10-12H2,1-5H3

Composition: C (66.85%), H (8.91%), N (13.76%), O (10.48%)

Molar Mass: 305.422

Atom Count: 49

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 305.210327121
Formal Charge 0
FSP3 0.65
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey WGIOAFJQUPMPKY-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.58
Topological Polar Surface Area 45.67
Polarizability 34.22
Ring Count 2
Rotatable Bond Count 4

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