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Home > Pyridines > 1179164-76-1
1179164-76-1 | 2-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}aniline
CAS No: 1179164-76-1 Catalog No: AG01A9L8 MDL No:MFCD16622132
Product Description
Catalog Number:
AG01A9L8
Chemical Name:
2-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}aniline
CAS Number:
1179164-76-1
Molecular Formula:
C17H22N4
Molecular Weight:
282.3834
MDL Number:
MFCD16622132
IUPAC Name:
2-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]aniline
InChI:
InChI=1S/C17H22N4/c18-16-3-1-2-4-17(16)21-13-11-20(12-14-21)10-7-15-5-8-19-9-6-15/h1-6,8-9H,7,10-14,18H2
InChI Key:
VVRLMBAHVDYVLI-UHFFFAOYSA-N
SMILES:
Nc1ccccc1N1CCN(CC1)CCc1ccncc1
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.184g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
282.391g/mol
Monoisotopic Mass:
282.184g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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