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Home > Other Heterocycles > 870890-29-2
870890-29-2 | Acetamide, N-[8-(4-cyano-1-naphthalenyl)-8-azabicyclo[3.2.1]oct-3-yl]-
CAS No: 870890-29-2 Catalog No: AG004LKH MDL No:
Product Description
Catalog Number:
AG004LKH
Chemical Name:
Acetamide, N-[8-(4-cyano-1-naphthalenyl)-8-azabicyclo[3.2.1]oct-3-yl]-
CAS Number:
870890-29-2
Molecular Formula:
C20H21N3O
Molecular Weight:
319.4002
IUPAC Name:
N-[8-(4-cyanonaphthalen-1-yl)-8-azabicyclo[3.2.1]octan-3-yl]acetamide
InChI:
InChI=1S/C20H21N3O/c1-13(24)22-15-10-16-7-8-17(11-15)23(16)20-9-6-14(12-21)18-4-2-3-5-19(18)20/h2-6,9,15-17H,7-8,10-11H2,1H3,(H,22,24)
InChI Key:
KTMFHLJBTSHVKQ-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c2c1cccc2)N1C2CCC1CC(C2)NC(=O)C
Properties
Complexity:
524
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.168g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
319.408g/mol
Monoisotopic Mass:
319.168g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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