Home Other Building Blocks 1-Pyridin-4-ylpiperidin-4-one

1-Pyridin-4-ylpiperidin-4-one

CAS No.:
126832-81-3
Catalog Number:
AG000TB6
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
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Product Description
Catalog Number:
AG000TB6
Chemical Name:
1-Pyridin-4-ylpiperidin-4-one
CAS Number:
126832-81-3
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
MDL Number:
MFCD13191635
IUPAC Name:
1-pyridin-4-ylpiperidin-4-one
InChI:
InChI=1S/C10H12N2O/c13-10-3-7-12(8-4-10)9-1-5-11-6-2-9/h1-2,5-6H,3-4,7-8H2
InChI Key:
MAXMUBIIZUKOJF-UHFFFAOYSA-N
SMILES:
O=C1CCN(CC1)c1ccncc1
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.095g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.219g/mol
Monoisotopic Mass:
176.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties