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1-{1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl}methanamine

1-{1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl}methanamine

CAS: 893755-01-6

Formula: C15H24N2O

SMILES: COC1=CC=C(CCN2CCC(CN)CC2)C=C1

IUPAC: 1-{1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl}methanamine

InChI: InChI=1S/C15H24N2O/c1-18-15-4-2-13(3-5-15)6-9-17-10-7-14(12-16)8-11-17/h2-5,14H,6-12,16H2,1H3

Composition: C (72.54%), H (9.74%), N (11.28%), O (6.44%)

Molar Mass: 248.37

Atom Count: 42

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 248.188863401
Formal Charge 0
FSP3 0.6
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey DRLMMRGAPIWHGO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 76.02
Topological Polar Surface Area 38.49
Polarizability 29.85
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 893755-01-6 $202.14$202.14
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