SDF/Mol File of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione (C11H20N4O2)

Structure Data File (SDF/MOL File) Description

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Additional Information for Identifying 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione Molecule

• Chemical structure of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione

  By visualizing the structure data file (SDF/MOL File) above, the chemical structure image of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione is available in chemical structure page of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione, which specifies the molecular geometry, i.e., the spatial arrangement of atoms and the chemical bonds that hold the atoms together.

• Molecular weight of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione

  The molecular weight of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione is available in molecular weight page of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione, which is calculated as the sum of the atomic masses of each constituent element multiplied by the number of atoms of that element.

• Chemical formula of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione

  The chemical formula of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione is given in chemical formula page of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• InChI (IUPAC International Chemical Identifier) information of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione

  An alternative way of expressing structural information in text format is InChI. The full standard InChI of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione is:

  InChI=1S/C11H20N4O2/c1-6-7-13(4)9-12-10(16)15(8(2)3)11(17)14(9)5/h8H,6-7H2,1-5H3

  It can provide a standard way to encode the molecular information of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione to facilitate the search for the compound information in databases and on the web.

  The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione is:

  InChIKey=IPUCNGAKZWLPOP-UHFFFAOYSA-N

  The InChIKey may allow easier web searches for 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione, but it needs to be linked to the full InChI to get back to the original structure of the 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione since the full standard InChI cannot be reconstructed from the InChIKey.

• Other names (synonyms) or registry numbers of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione

  The 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione compound may be named differently depending on the various situations of industrial applications. Other names (synonyms) of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione including the registry numbers are listed below, if available:

  
  
  None available.

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1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione Identification Summary Frequently Asked Questions (FAQs)

What’s the 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione formula?
C11H20N4O2
How many atoms and what elements are included in the 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione molecule?
37 atom(s) - 20 Hydrogen atom(s), 11 Carbon atom(s), 4 Nitrogen atom(s), and 2 Oxygen atom(s)
How many chemical bonds and what kind of bonds are in the 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione structure?
37 bond(s) - 17 non-H bond(s), 3 multiple bond(s), 4 rotatable bond(s), 3 double bond(s), 1 six-membered ring(s), 1 urea (-thio) derivative(s), 1 guanidine derivative(s), 1 tertiary amine(s) (aliphatic), and 1 imide(s) (-thio)
What’s the 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione’s molar mass?
240.3021 g/mol
What’s the SMILES structure of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione?
CCCN(C)c1nc(=O)n(C(C)C)c(=O)n1C
What’s the InChI code of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione?
InChI=1S/C11H20N4O2/c1-6-7-13(4)9-12-10(16)15(8(2)3)11(17)14(9)5/h8H,6-7H2,1-5H3
What’s the InChIKey format of 1-methyl-6-[methyl(propyl)amino]-3-(propan-2-yl)-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione?
IPUCNGAKZWLPOP-UHFFFAOYSA-N

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