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Home > Pyridines > 223794-93-2
223794-93-2 | 1-(5-methoxypyridin-3-yl)piperazine
CAS No: 223794-93-2 Catalog No: AG01BV3U MDL No:MFCD11872719
Product Description
Catalog Number:
AG01BV3U
Chemical Name:
1-(5-methoxypyridin-3-yl)piperazine
CAS Number:
223794-93-2
Molecular Formula:
C10H15N3O
Molecular Weight:
193.2456
MDL Number:
MFCD11872719
IUPAC Name:
1-(5-methoxypyridin-3-yl)piperazine
InChI:
InChI=1S/C10H15N3O/c1-14-10-6-9(7-12-8-10)13-4-2-11-3-5-13/h6-8,11H,2-5H2,1H3
InChI Key:
HSIGWPYNPCNTCE-UHFFFAOYSA-N
SMILES:
COc1cncc(c1)N1CCNCC1
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.122g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.25g/mol
Monoisotopic Mass:
193.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| New ligands with affinity for the alpha4beta2 subtype of nicotinic acetylcholine receptors. Synthesis, receptor binding, and 3D-QSAR modeling. | Journal of medicinal chemistry 20060601 |
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