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ethyl 1-{2-[(2H-1,3-benzodioxol-5-yl)carbamoyl]ethyl}piperidine-3-carboxylate

ethyl 1-{2-[(2H-1,3-benzodioxol-5-yl)carbamoyl]ethyl}piperidine-3-carboxylate

Formula: C18H24N2O5

SMILES: CCOC(=O)C1CCCN(CCC(=O)NC2=CC=C3OCOC3=C2)C1

IUPAC: ethyl 1-{2-[(2H-1,3-benzodioxol-5-yl)carbamoyl]ethyl}piperidine-3-carboxylate

InChI: InChI=1/C18H24N2O5/c1-2-23-18(22)13-4-3-8-20(11-13)9-7-17(21)19-14-5-6-15-16(10-14)25-12-24-15/h5-6,10,13H,2-4,7-9,11-12H2,1H3,(H,19,21)

Composition: C (62.05%), H (6.94%), N (8.04%), O (22.96%)

Molar Mass: 348.399

Atom Count: 49

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 348.168521881
Formal Charge 0
FSP3 0.56
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey CFPGBWPMBGCJOM-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 92.56
Topological Polar Surface Area 77.1
Polarizability 35.85
Ring Count 3
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H24N2O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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