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113445-71-9 | Propanamide, N-(4-aminophenyl)-N-[1-(2-phenylethyl)-4-piperidinyl]-
CAS No: 113445-71-9 Catalog No: AG0008LX MDL No:
Product Description
Catalog Number:
AG0008LX
Chemical Name:
Propanamide, N-(4-aminophenyl)-N-[1-(2-phenylethyl)-4-piperidinyl]-
CAS Number:
113445-71-9
Molecular Formula:
C22H29N3O
Molecular Weight:
351.4852
IUPAC Name:
N-(4-aminophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
InChI:
InChI=1S/C22H29N3O/c1-2-22(26)25(20-10-8-19(23)9-11-20)21-13-16-24(17-14-21)15-12-18-6-4-3-5-7-18/h3-11,21H,2,12-17,23H2,1H3
InChI Key:
IQCBKRHBFMYHDV-UHFFFAOYSA-N
SMILES:
CCC(=O)N(c1ccc(cc1)N)C1CCN(CC1)CCc1ccccc1
Properties
Complexity:
419
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.231g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
351.494g/mol
Monoisotopic Mass:
351.231g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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