Home Other Building Blocks 2,2,2-trifluoro-N-(piperidin-4-yl)-N-(pyridin-3-yl)acetamide dihydrochloride

2,2,2-trifluoro-N-(piperidin-4-yl)-N-(pyridin-3-yl)acetamide dihydrochloride

CAS No.:
1955499-55-4
Catalog Number:
AG01B2MS
Molecular Formula:
C12H16Cl2F3N3O
Molecular Weight:
346.1761
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Product Description
Catalog Number:
AG01B2MS
Chemical Name:
2,2,2-trifluoro-N-(piperidin-4-yl)-N-(pyridin-3-yl)acetamide dihydrochloride
CAS Number:
1955499-55-4
Molecular Formula:
C12H16Cl2F3N3O
Molecular Weight:
346.1761
MDL Number:
MFCD29991666
IUPAC Name:
2,2,2-trifluoro-N-piperidin-4-yl-N-pyridin-3-ylacetamide;dihydrochloride
InChI:
InChI=1S/C12H14F3N3O.2ClH/c13-12(14,15)11(19)18(9-3-6-16-7-4-9)10-2-1-5-17-8-10;;/h1-2,5,8-9,16H,3-4,6-7H2;2*1H
InChI Key:
KOVAEWLSWNACDI-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)N(c1cccnc1)C1CCNCC1.Cl.Cl
Properties
Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.062g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
346.175g/mol
Monoisotopic Mass:
345.062g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties