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4-[2-(3-phenylpropoxy)ethyl]piperidine

4-[2-(3-phenylpropoxy)ethyl]piperidine

CAS: 907159-15-3

Formula: C16H25NO

SMILES: C(COCCC1CCNCC1)CC1=CC=CC=C1

IUPAC: 4-[2-(3-phenylpropoxy)ethyl]piperidine

InChI: InChI=1S/C16H25NO/c1-2-5-15(6-3-1)7-4-13-18-14-10-16-8-11-17-12-9-16/h1-3,5-6,16-17H,4,7-14H2

Composition: C (77.68%), H (10.19%), N (5.66%), O (6.47%)

Molar Mass: 247.382

Atom Count: 43

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 247.193614429
Formal Charge 0
FSP3 0.62
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey LSAORFPJNKAXIO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 76.63
Topological Polar Surface Area 21.26
Polarizability 30.19
Ring Count 2
Rotatable Bond Count 7

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