Home Nitriles 2-(4-formylpiperazin-1-yl)pyridine-3-carbonitrile

2-(4-formylpiperazin-1-yl)pyridine-3-carbonitrile

CAS No.:
1225710-24-6
Catalog Number:
AG019TJB
Molecular Formula:
C11H12N4O
Molecular Weight:
216.2392
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Product Description
Catalog Number:
AG019TJB
Chemical Name:
2-(4-formylpiperazin-1-yl)pyridine-3-carbonitrile
CAS Number:
1225710-24-6
Molecular Formula:
C11H12N4O
Molecular Weight:
216.2392
MDL Number:
MFCD16309340
IUPAC Name:
2-(4-formylpiperazin-1-yl)pyridine-3-carbonitrile
InChI:
InChI=1S/C11H12N4O/c12-8-10-2-1-3-13-11(10)15-6-4-14(9-16)5-7-15/h1-3,9H,4-7H2
InChI Key:
NVPSNBQWSKTOKA-UHFFFAOYSA-N
SMILES:
O=CN1CCN(CC1)c1ncccc1C#N
Properties
Complexity:
290  
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:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.244g/mol
Monoisotopic Mass:
216.101g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties