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Guanidine, [3-[5-(4-aminobutyl)-3,6-dioxo-2-piperazinyl]propyl]-

HCID 10401627
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Basic information

CAS
160886-50-0
Standard SMILES
NCCCCC1NC(=O)C(CCCN=C(N)N)NC1=O
InChIKey
JDPFTDBPJMLYNK-UHFFFAOYSA-N
Molecular formula
C12H24N6O2
Average molar mass
284.36 g/mol
Monoisotopic mass
284.19607403

Names & identifiers

Preferred name
Guanidine, [3-[5-(4-aminobutyl)-3,6-dioxo-2-piperazinyl]propyl]-
IUPAC
2-[3-[5-(4-aminobutyl)-3,6-dioxopiperazin-2-yl]propyl]guanidine

Names & synonyms

160886-50-0Guanidine, [3-[5-(4-aminobutyl)-3,6-dioxo-2-piperazinyl]propyl]-DTXSID40439355N''-{3-[5-(4-AMINOBUTYL)-3,6-DIOXOPIPERAZIN-2-YL]PROPYL}GUANIDINE

Database identifiers

CAS
160886-50-0
PubChem CID
10401627
DTXSID
DTXSID40439355

Properties

Computed structural properties

XLogP
-1.9
Topological polar surface area
149 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
20
Formal charge
0
Complexity
367

Related reactions

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Compound notes

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