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1-benzyl 3-ethyl 5-hydroxypiperidine-1,3-dicarboxylate

1-benzyl 3-ethyl 5-hydroxypiperidine-1,3-dicarboxylate

CAS: 1095010-49-3

Formula: C16H21NO5

SMILES: CCOC(=O)C1CC(O)CN(C1)C(=O)OCC1=CC=CC=C1

IUPAC: 1-benzyl 3-ethyl 5-hydroxypiperidine-1,3-dicarboxylate

InChI: InChI=1/C16H21NO5/c1-2-21-15(19)13-8-14(18)10-17(9-13)16(20)22-11-12-6-4-3-5-7-12/h3-7,13-14,18H,2,8-11H2,1H3

Composition: C (62.53%), H (6.89%), N (4.56%), O (26.03%)

Molar Mass: 307.346

Atom Count: 43

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 307.14197278
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey QDHWQJOSWSDMQA-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 79.6
Topological Polar Surface Area 76.07
Polarizability 31.34
Ring Count 2
Rotatable Bond Count 6

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