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tert-butyl 4-({[4-(ethylamino)pyrimidin-2-yl]oxy}methyl)piperidine-1-carboxylate

tert-butyl 4-({[4-(ethylamino)pyrimidin-2-yl]oxy}methyl)piperidine-1-carboxylate

Formula: C17H28N4O3

SMILES: CCNC1=NC(OCC2CCN(CC2)C(=O)OC(C)(C)C)=NC=C1

IUPAC: tert-butyl 4-({[4-(ethylamino)pyrimidin-2-yl]oxy}methyl)piperidine-1-carboxylate

InChI: InChI=1S/C17H28N4O3/c1-5-18-14-6-9-19-15(20-14)23-12-13-7-10-21(11-8-13)16(22)24-17(2,3)4/h6,9,13H,5,7-8,10-12H2,1-4H3,(H,18,19,20)

Composition: C (60.69%), H (8.39%), N (16.65%), O (14.27%)

Molar Mass: 336.436

Atom Count: 52

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 336.216140778
Formal Charge 0
FSP3 0.71
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey UXGFHBBJHBDDDM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 94.36
Topological Polar Surface Area 76.58
Polarizability 35.5
Ring Count 2
Rotatable Bond Count 7

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Purity (%)
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Purity LeadTime Formula UnitPrice
98% <10 Days C17H28N4O3 Quote Only