Home Other Building Blocks N-(2-Aminoethyl)isonicotinamide

N-(2-Aminoethyl)isonicotinamide

CAS No.:
17704-88-0
Catalog Number:
AG002535
Molecular Formula:
C8H11N3O
Molecular Weight:
165.1924
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG002535
Chemical Name:
N-(2-Aminoethyl)isonicotinamide
CAS Number:
17704-88-0
Molecular Formula:
C8H11N3O
Molecular Weight:
165.1924
MDL Number:
MFCD01332312
IUPAC Name:
N-(2-aminoethyl)pyridine-4-carboxamide
InChI:
InChI=1S/C8H11N3O/c9-3-6-11-8(12)7-1-4-10-5-2-7/h1-2,4-5H,3,6,9H2,(H,11,12)
InChI Key:
BYBVGGPVHPUBSJ-UHFFFAOYSA-N
SMILES:
NCCNC(=O)c1ccncc1
Properties
Complexity:
143  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.09g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
165.196g/mol
Monoisotopic Mass:
165.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties