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Home > Imidazoles > 103692-68-8
103692-68-8 | 2-Pyridinecarboxamide, N-[2-(1H-imidazol-4-yl)ethyl]-
CAS No: 103692-68-8 Catalog No: AG0085GC MDL No:
Product Description
Catalog Number:
AG0085GC
Chemical Name:
2-Pyridinecarboxamide, N-[2-(1H-imidazol-4-yl)ethyl]-
CAS Number:
103692-68-8
Molecular Formula:
C11H12N4O
Molecular Weight:
216.2392
IUPAC Name:
N-[2-(1H-imidazol-5-yl)ethyl]pyridine-2-carboxamide
InChI:
InChI=1S/C11H12N4O/c16-11(10-3-1-2-5-13-10)14-6-4-9-7-12-8-15-9/h1-3,5,7-8H,4,6H2,(H,12,15)(H,14,16)
InChI Key:
YZQYDORFRUFWIK-UHFFFAOYSA-N
SMILES:
O=C(c1ccccn1)NCCc1c[nH]cn1
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.101g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.244g/mol
Monoisotopic Mass:
216.101g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
70.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Literature
| Title | Journal |
|---|---|
| Synthetic analogue approach to metallobleomycins: syntheses, structure and properties of mononuclear and tetranuclear gallium(III) complexes of a ligand that resembles the metal-binding site of bleomycin. | Journal of inorganic biochemistry 20041201 |
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