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121885-08-3 | 2-Piperazinecarboxamide, N,N-diethyl-
CAS No: 121885-08-3 Catalog No: AG0016CL MDL No:
Product Description
Catalog Number:
AG0016CL
Chemical Name:
2-Piperazinecarboxamide, N,N-diethyl-
CAS Number:
121885-08-3
Molecular Formula:
C9H19N3O
Molecular Weight:
185.2667
IUPAC Name:
N,N-diethylpiperazine-2-carboxamide
InChI:
InChI=1S/C9H19N3O/c1-3-12(4-2)9(13)8-7-10-5-6-11-8/h8,10-11H,3-7H2,1-2H3
InChI Key:
IPYUFNHTPJFYKY-UHFFFAOYSA-N
SMILES:
CCN(C(=O)C1NCCNC1)CC
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.153g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
185.271g/mol
Monoisotopic Mass:
185.153g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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