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824431-90-5 | Pyridine, 4-[(1-cyclopentyl-2-methyl-1H-imidazol-4-yl)ethynyl]-2-methyl-
CAS No: 824431-90-5 Catalog No: AG0050QE MDL No:
Product Description
Catalog Number:
AG0050QE
Chemical Name:
Pyridine, 4-[(1-cyclopentyl-2-methyl-1H-imidazol-4-yl)ethynyl]-2-methyl-
CAS Number:
824431-90-5
Molecular Formula:
C17H19N3
Molecular Weight:
265.3529
IUPAC Name:
4-[2-(1-cyclopentyl-2-methylimidazol-4-yl)ethynyl]-2-methylpyridine
InChI:
InChI=1S/C17H19N3/c1-13-11-15(9-10-18-13)7-8-16-12-20(14(2)19-16)17-5-3-4-6-17/h9-12,17H,3-6H2,1-2H3
InChI Key:
UFAQSDQVHLWGPY-UHFFFAOYSA-N
SMILES:
Cc1nccc(c1)C#Cc1cn(c(n1)C)C1CCCC1
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.158g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.36g/mol
Monoisotopic Mass:
265.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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