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tert-butyl 4-(2-aminobenzamido)piperidine-1-carboxylate

tert-butyl 4-(2-aminobenzamido)piperidine-1-carboxylate

CAS: 1021284-59-2

Formula: C17H25N3O3

SMILES: CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C1=C(N)C=CC=C1

IUPAC: tert-butyl 4-(2-aminobenzamido)piperidine-1-carboxylate

InChI: InChI=1S/C17H25N3O3/c1-17(2,3)23-16(22)20-10-8-12(9-11-20)19-15(21)13-6-4-5-7-14(13)18/h4-7,12H,8-11,18H2,1-3H3,(H,19,21)

Composition: C (63.93%), H (7.89%), N (13.16%), O (15.03%)

Molar Mass: 319.405

Atom Count: 48

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 319.189591677
Formal Charge 0
FSP3 0.53
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey ONNHWRRTROXKKH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 89.88
Topological Polar Surface Area 84.66
Polarizability 33.9
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1021284-59-2 $51.35-$120.18$51.35$63.37$75.38$86.31$120.18
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