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Home > Other Heterocycles > 85675-29-2
85675-29-2 | 2-Azaspiro[5.5]undec-8-ene-2-carboxamide, N-butyl-8,9-dimethyl-
CAS No: 85675-29-2 Catalog No: AG004T5F MDL No:
Product Description
Catalog Number:
AG004T5F
Chemical Name:
2-Azaspiro[5.5]undec-8-ene-2-carboxamide, N-butyl-8,9-dimethyl-
CAS Number:
85675-29-2
Molecular Formula:
C17H30N2O
Molecular Weight:
278.4329
IUPAC Name:
N-butyl-9,10-dimethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide
InChI:
InChI=1S/C17H30N2O/c1-4-5-10-18-16(20)19-11-6-8-17(13-19)9-7-14(2)15(3)12-17/h4-13H2,1-3H3,(H,18,20)
InChI Key:
RIEYVBAAXKRHKO-UHFFFAOYSA-N
SMILES:
CCCCNC(=O)N1CCCC2(C1)CCC(=C(C2)C)C
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.236g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.44g/mol
Monoisotopic Mass:
278.236g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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