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Home > Pyridines > 864816-98-8
864816-98-8 | 1-(piperazin-1-yl)-2-(pyridin-2-yl)ethan-1-one
CAS No: 864816-98-8 Catalog No: AG01ADCA MDL No:MFCD10695278
Product Description
Catalog Number:
AG01ADCA
Chemical Name:
1-(piperazin-1-yl)-2-(pyridin-2-yl)ethan-1-one
CAS Number:
864816-98-8
Molecular Formula:
C11H15N3O
Molecular Weight:
205.2563
MDL Number:
MFCD10695278
IUPAC Name:
1-piperazin-1-yl-2-pyridin-2-ylethanone
InChI:
InChI=1S/C11H15N3O/c15-11(14-7-5-12-6-8-14)9-10-3-1-2-4-13-10/h1-4,12H,5-9H2
InChI Key:
AFRPKDVGDIETFE-UHFFFAOYSA-N
SMILES:
O=C(N1CCNCC1)Cc1ccccn1
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.122g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.261g/mol
Monoisotopic Mass:
205.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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