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tert-butyl N-[2-(4-methylpiperazin-1-yl)ethyl]carbamate

tert-butyl N-[2-(4-methylpiperazin-1-yl)ethyl]carbamate

CAS: 1484327-92-5

Formula: C12H25N3O2

SMILES: CN1CCN(CCNC(=O)OC(C)(C)C)CC1

IUPAC: tert-butyl N-[2-(4-methylpiperazin-1-yl)ethyl]carbamate

InChI: InChI=1S/C12H25N3O2/c1-12(2,3)17-11(16)13-5-6-15-9-7-14(4)8-10-15/h5-10H2,1-4H3,(H,13,16)

Composition: C (59.23%), H (10.36%), N (17.27%), O (13.15%)

Molar Mass: 243.351

Atom Count: 42

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 243.194677057
Formal Charge 0
FSP3 0.92
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey SXGDQOAVMOEVSY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.86
Topological Polar Surface Area 44.81
Polarizability 27.06
Ring Count 1
Rotatable Bond Count 5

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