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896053-97-7 | Benzyl-ethyl-piperidin-3-ylmethyl-amine
CAS No: 896053-97-7 Catalog No: AG01FCHE MDL No:
Product Description
Catalog Number:
AG01FCHE
Chemical Name:
Benzyl-ethyl-piperidin-3-ylmethyl-amine
CAS Number:
896053-97-7
Molecular Formula:
C15H24N2
Molecular Weight:
232.3645
IUPAC Name:
N-benzyl-N-(piperidin-3-ylmethyl)ethanamine
InChI:
InChI=1S/C15H24N2/c1-2-17(12-14-7-4-3-5-8-14)13-15-9-6-10-16-11-15/h3-5,7-8,15-16H,2,6,9-13H2,1H3
InChI Key:
XVMDVZQLPOVYQP-UHFFFAOYSA-N
SMILES:
CCN(Cc1ccccc1)CC1CCCNC1
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.194g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.371g/mol
Monoisotopic Mass:
232.194g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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