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166809-67-2 | Ethanone, 1-[1-(3-aminopropyl)-4-phenyl-4-piperidinyl]-
CAS No: 166809-67-2 Catalog No: AG001WYA MDL No:
Product Description
Catalog Number:
AG001WYA
Chemical Name:
Ethanone, 1-[1-(3-aminopropyl)-4-phenyl-4-piperidinyl]-
CAS Number:
166809-67-2
Molecular Formula:
C16H24N2O
Molecular Weight:
260.3746
IUPAC Name:
1-[1-(3-aminopropyl)-4-phenylpiperidin-4-yl]ethanone
InChI:
InChI=1S/C16H24N2O/c1-14(19)16(15-6-3-2-4-7-15)8-12-18(13-9-16)11-5-10-17/h2-4,6-7H,5,8-13,17H2,1H3
InChI Key:
NTQVHBVWXDUWGU-UHFFFAOYSA-N
SMILES:
NCCCN1CCC(CC1)(C(=O)C)c1ccccc1
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.189g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.381g/mol
Monoisotopic Mass:
260.189g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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