Home Aminos 3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-5-methylhexanamide dihydrochloride

3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-5-methylhexanamide dihydrochloride

CAS No.:
1909319-81-8
Catalog Number:
AG01C449
Molecular Formula:
C15H25Cl2FN2O
Molecular Weight:
339.2762
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Product Description
Catalog Number:
AG01C449
Chemical Name:
3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-5-methylhexanamide dihydrochloride
CAS Number:
1909319-81-8
Molecular Formula:
C15H25Cl2FN2O
Molecular Weight:
339.2762
MDL Number:
MFCD29763001
IUPAC Name:
3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-5-methylhexanamide;dihydrochloride
InChI:
InChI=1S/C15H23FN2O.2ClH/c1-11(2)7-13(9-17)8-15(19)18-10-12-3-5-14(16)6-4-12;;/h3-6,11,13H,7-10,17H2,1-2H3,(H,18,19);2*1H
InChI Key:
NTMJBGYFKMEZTQ-UHFFFAOYSA-N
SMILES:
NCC(CC(=O)NCc1ccc(cc1)F)CC(C)C.Cl.Cl
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.133g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
339.276g/mol
Monoisotopic Mass:
338.133g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties