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Home > Other Heterocycles > 823813-03-2
823813-03-2 | Benzamide, 4-(8-azabicyclo[3.2.1]oct-3-ylidenemethyl)-N-ethyl-
CAS No: 823813-03-2 Catalog No: AG004Y0G MDL No:
Product Description
Catalog Number:
AG004Y0G
Chemical Name:
Benzamide, 4-(8-azabicyclo[3.2.1]oct-3-ylidenemethyl)-N-ethyl-
CAS Number:
823813-03-2
Molecular Formula:
C17H22N2O
Molecular Weight:
270.3694
IUPAC Name:
4-(8-azabicyclo[3.2.1]octan-3-ylidenemethyl)-N-ethylbenzamide
InChI:
InChI=1S/C17H22N2O/c1-2-18-17(20)14-5-3-12(4-6-14)9-13-10-15-7-8-16(11-13)19-15/h3-6,9,15-16,19H,2,7-8,10-11H2,1H3,(H,18,20)
InChI Key:
NVNARYDYQMXYTH-UHFFFAOYSA-N
SMILES:
CCNC(=O)c1ccc(cc1)C=C1CC2CCC(C1)N2
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.173g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
270.376g/mol
Monoisotopic Mass:
270.173g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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