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101651-66-5

101651-66-5 | Acetamide, N-(2-chlorophenyl)-2-[methyl[2-(1-piperidinyl)ethyl]amino]-, hydrochloride (1:2)

CAS No: 101651-66-5 Catalog No: AG000526 MDL No:

Product Description

Catalog Number:
AG000526
Chemical Name:
Acetamide, N-(2-chlorophenyl)-2-[methyl[2-(1-piperidinyl)ethyl]amino]-, hydrochloride (1:2)
CAS Number:
101651-66-5
Molecular Formula:
C16H26Cl3N3O
Molecular Weight:
382.7561
IUPAC Name:
[2-(2-chloroanilino)-2-oxoethyl]-methyl-(2-piperidin-1-ylethyl)azanium;dichloride
InChI:
InChI=1S/2C16H24ClN3O.2ClH/c2*1-19(11-12-20-9-5-2-6-10-20)13-16(21)18-15-8-4-3-7-14(15)17;;/h2*3-4,7-8H,2,5-6,9-13H2,1H3,(H,18,21);2*1H
InChI Key:
LLUIBTYQVSTKHT-UHFFFAOYSA-N
SMILES:
CN(CC(=O)Nc1ccccc1Cl)CCN1CCCCC1.Cl.Cl

Properties

Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
692.272g/mol
Formal Charge:
0
Heavy Atom Count:
44  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
692.592g/mol
Monoisotopic Mass:
690.275g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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