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155125-71-6 | Propanamide, N-[1-(4-chloro-3-penten-1-yl)-3-methyl-4-piperidinyl]-N-phenyl-
CAS No: 155125-71-6 Catalog No: AG001NMY MDL No:
Product Description
Catalog Number:
AG001NMY
Chemical Name:
Propanamide, N-[1-(4-chloro-3-penten-1-yl)-3-methyl-4-piperidinyl]-N-phenyl-
CAS Number:
155125-71-6
Molecular Formula:
C20H29ClN2O
Molecular Weight:
348.9101
IUPAC Name:
N-[1-(4-chloropent-3-enyl)-3-methylpiperidin-4-yl]-N-phenylpropanamide
InChI:
InChI=1S/C20H29ClN2O/c1-4-20(24)23(18-10-6-5-7-11-18)19-12-14-22(15-16(19)2)13-8-9-17(3)21/h5-7,9-11,16,19H,4,8,12-15H2,1-3H3
InChI Key:
IKFXOJSVDKIILX-UHFFFAOYSA-N
SMILES:
CCC(=O)N(C1CCN(CC1C)CCC=C(Cl)C)c1ccccc1
Properties
Complexity:
431
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.197g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
348.915g/mol
Monoisotopic Mass:
348.197g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
4.5
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