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1353954-44-5 | 2-[3-(Benzyl-methyl-amino)-piperidin-1-yl]-ethanol
CAS No: 1353954-44-5 Catalog No: AG01F901 MDL No:
Product Description
Catalog Number:
AG01F901
Chemical Name:
2-[3-(Benzyl-methyl-amino)-piperidin-1-yl]-ethanol
CAS Number:
1353954-44-5
Molecular Formula:
C15H24N2O
Molecular Weight:
248.3639
IUPAC Name:
2-[3-[benzyl(methyl)amino]piperidin-1-yl]ethanol
InChI:
InChI=1S/C15H24N2O/c1-16(12-14-6-3-2-4-7-14)15-8-5-9-17(13-15)10-11-18/h2-4,6-7,15,18H,5,8-13H2,1H3
InChI Key:
CUNBLCVPFGTCRK-UHFFFAOYSA-N
SMILES:
OCCN1CCCC(C1)N(Cc1ccccc1)C
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.189g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.37g/mol
Monoisotopic Mass:
248.189g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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