chempirical

Hexazinone

C12H20N4O2CAS 51235-04-2252.32 g/mol

Open in Covalent MOL file
NNONON
Tertiary amine

Properties

Molecular formula
C12H20N4O2
Molar mass
252.32 g/mol
Exact mass
252.1586 Da
Density
1.25 g/mL
Melting point
115–117 °C
logP
0.51Crippen estimate
Polar surface area
60.1 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
2

Identifiers

CAS number
51235-04-2
SMILES
CN(C)c1nc(=O)n(C2CCCCC2)c(=O)n1C
InChIKey
CAWXEEYDBZRFPE-UHFFFAOYSA-N
InChI
InChI=1S/C12H20N4O2/c1-14(2)10-13-11(17)16(12(18)15(10)3)9-7-5-4-6-8-9/h9H,4-8H2,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

9 names
  • 1,3,5-Triazine-2,4(1H,3H)-dione, 3-cyclohexyl-6-(dimethylamino)-1-methyl-
  • 3-Cyclohexyl-6-(dimethylamino)-1-methyl-1,3,5-triazine-2,4(1H,3H)-dione
  • Velpar
  • DPX 3674
  • 3-Cyclohexyl-6-(dimethylamino)-1-methyl-s-triazine-2,4(1H,3H)-dione
  • Velpar L
  • Pronone
  • Pronone 10G
  • Hexaxinon

Work with Hexazinone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

8-(Dimethylamino)-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dione5426-47-130 % similar 2-Chloro-7-cyclopentyl-N,N-dimethyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide1211443-61-630 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia