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88327-65-5 | Pyrrolo[1,2-a]pyrazine-2(1H)-carboxamide, N,N-diethylhexahydro-
CAS No: 88327-65-5 Catalog No: AG0048BB MDL No:
Product Description
Catalog Number:
AG0048BB
Chemical Name:
Pyrrolo[1,2-a]pyrazine-2(1H)-carboxamide, N,N-diethylhexahydro-
CAS Number:
88327-65-5
Molecular Formula:
C12H23N3O
Molecular Weight:
225.3305
IUPAC Name:
N,N-diethyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
InChI:
InChI=1S/C12H23N3O/c1-3-13(4-2)12(16)15-9-8-14-7-5-6-11(14)10-15/h11H,3-10H2,1-2H3
InChI Key:
JDHGNODYKVJAID-UHFFFAOYSA-N
SMILES:
CCN(C(=O)N1CCN2C(C1)CCC2)CC
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.184g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.336g/mol
Monoisotopic Mass:
225.184g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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