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Home > Other Heterocycles > 823812-86-8
823812-86-8 | Benzamide, 4-(8-azabicyclo[3.2.1]oct-3-ylidenemethyl)-N-methyl-
CAS No: 823812-86-8 Catalog No: AG005CT9 MDL No:
Product Description
Catalog Number:
AG005CT9
Chemical Name:
Benzamide, 4-(8-azabicyclo[3.2.1]oct-3-ylidenemethyl)-N-methyl-
CAS Number:
823812-86-8
Molecular Formula:
C16H20N2O
Molecular Weight:
256.3428
IUPAC Name:
4-(8-azabicyclo[3.2.1]octan-3-ylidenemethyl)-N-methylbenzamide
InChI:
InChI=1S/C16H20N2O/c1-17-16(19)13-4-2-11(3-5-13)8-12-9-14-6-7-15(10-12)18-14/h2-5,8,14-15,18H,6-7,9-10H2,1H3,(H,17,19)
InChI Key:
GEMUZDXWIWZXDH-UHFFFAOYSA-N
SMILES:
CNC(=O)c1ccc(cc1)C=C1CC2CCC(C1)N2
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.158g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
256.349g/mol
Monoisotopic Mass:
256.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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