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198823-22-2 | 1-Propanol, 3-[[1-(phenylmethyl)-4-piperidinyl]amino]-
CAS No: 198823-22-2 Catalog No: AG002BRE MDL No:
Product Description
Catalog Number:
AG002BRE
Chemical Name:
1-Propanol, 3-[[1-(phenylmethyl)-4-piperidinyl]amino]-
CAS Number:
198823-22-2
Molecular Formula:
C15H24N2O
Molecular Weight:
248.3639
IUPAC Name:
3-[(1-benzylpiperidin-4-yl)amino]propan-1-ol
InChI:
InChI=1S/C15H24N2O/c18-12-4-9-16-15-7-10-17(11-8-15)13-14-5-2-1-3-6-14/h1-3,5-6,15-16,18H,4,7-13H2
InChI Key:
QLTWYVLPFXWGIX-UHFFFAOYSA-N
SMILES:
OCCCNC1CCN(CC1)Cc1ccccc1
Properties
Complexity:
209
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:
2
Isotope Atom Count:
0
Molecular Weight:
248.37g/mol
Monoisotopic Mass:
248.189g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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