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3,5-Piperidinedicarbonitrile, 2,6-dioxo-4-hexyl-4-methyl-

HCID 200026
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Basic information

CAS
5512-92-5
Standard SMILES
CCCCCCC1(C)C(C#N)C(=O)NC(=O)C1C#N
InChIKey
JFOVBTOGAPZLSM-UHFFFAOYSA-N
Molecular formula
C14H19N3O2
Average molar mass
261.32 g/mol
Monoisotopic mass
261.14772686

Names & identifiers

Preferred name
3,5-Piperidinedicarbonitrile, 2,6-dioxo-4-hexyl-4-methyl-
IUPAC
4-hexyl-4-methyl-2,6-dioxopiperidine-3,5-dicarbonitrile

Names & synonyms

3,5-Piperidinedicarbonitrile, 2,6-dioxo-4-hexyl-4-methyl-5512-92-5RefChem:1065963BRN 02491032,4-Dicyano-3-hexyl-3-methylglutarimideGlutarimide, 2,4-dicyano-3-hexyl-3-methyl-1-22-00-00598 (Beilstein Handbook Reference)DTXSID109704824-Hexyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile

Database identifiers

CAS
5512-92-5
PubChem CID
200026

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
93.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
19
Formal charge
0
Complexity
432

Related reactions

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Compound notes

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