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1353944-61-2 | 2-[3-(Benzyl-ethyl-amino)-piperidin-1-yl]-ethanol
CAS No: 1353944-61-2 Catalog No: AG01F998 MDL No:
Product Description
Catalog Number:
AG01F998
Chemical Name:
2-[3-(Benzyl-ethyl-amino)-piperidin-1-yl]-ethanol
CAS Number:
1353944-61-2
Molecular Formula:
C16H26N2O
Molecular Weight:
262.3904
IUPAC Name:
2-[3-[benzyl(ethyl)amino]piperidin-1-yl]ethanol
InChI:
InChI=1S/C16H26N2O/c1-2-18(13-15-7-4-3-5-8-15)16-9-6-10-17(14-16)11-12-19/h3-5,7-8,16,19H,2,6,9-14H2,1H3
InChI Key:
JUHQOVHXDNEWLX-UHFFFAOYSA-N
SMILES:
OCCN1CCCC(C1)N(Cc1ccccc1)CC
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.205g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.397g/mol
Monoisotopic Mass:
262.205g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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