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121348-11-6

121348-11-6 | 5-acetyl-6-methyl-2-(piperidin-1-yl)pyridine-3-carbonitrile

CAS No: 121348-11-6 Catalog No: AG00INJO MDL No:MFCD00793588

Product Description

Catalog Number:
AG00INJO
Chemical Name:
5-acetyl-6-methyl-2-(piperidin-1-yl)pyridine-3-carbonitrile
CAS Number:
121348-11-6
Molecular Formula:
C14H17N3O
Molecular Weight:
243.3043
MDL Number:
MFCD00793588
IUPAC Name:
5-acetyl-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile
InChI:
InChI=1S/C14H17N3O/c1-10-13(11(2)18)8-12(9-15)14(16-10)17-6-4-3-5-7-17/h8H,3-7H2,1-2H3
InChI Key:
SPJTZYKHTQMLJY-UHFFFAOYSA-N
SMILES:
N#Cc1cc(C(=O)C)c(nc1N1CCCCC1)C

Properties

Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.137g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.31g/mol
Monoisotopic Mass:
243.137g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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