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646057-09-2 | Spiro[1-azabicyclo[2.2.1]heptane-7,3'-pyrrolidine], 1'-(5-pyrimidinyl)-
CAS No: 646057-09-2 Catalog No: AG006SPJ MDL No:
Product Description
Catalog Number:
AG006SPJ
Chemical Name:
Spiro[1-azabicyclo[2.2.1]heptane-7,3'-pyrrolidine], 1'-(5-pyrimidinyl)-
CAS Number:
646057-09-2
Molecular Formula:
C13H18N4
Molecular Weight:
230.3088
IUPAC Name:
1'-pyrimidin-5-ylspiro[1-azabicyclo[2.2.1]heptane-7,3'-pyrrolidine]
InChI:
InChI=1S/C13H18N4/c1-4-17-5-2-11(1)13(17)3-6-16(9-13)12-7-14-10-15-8-12/h7-8,10-11H,1-6,9H2
InChI Key:
IFVICKYUFQMIHT-UHFFFAOYSA-N
SMILES:
c1ncc(cn1)N1CCC2(C1)C1CCN2CC1
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.153g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.315g/mol
Monoisotopic Mass:
230.153g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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