SDF/Mol File of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide (C22H25N3O2)

Structure Data File (SDF/MOL File) Description

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Additional Information for Identifying N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide Molecule

• Chemical structure of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide

  By visualizing the structure data file (SDF/MOL File) above, the chemical structure image of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide is available in chemical structure page of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide, which specifies the molecular geometry, i.e., the spatial arrangement of atoms and the chemical bonds that hold the atoms together.

• Molecular weight of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide

  The molecular weight of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide is available in molecular weight page of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide, 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 N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide

  The chemical formula of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide is given in chemical formula page of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide, 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 N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide

  An alternative way of expressing structural information in text format is InChI. The full standard InChI of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide is:

  InChI=1S/C22H25N3O2/c1-4-25(5-2)19-9-7-18(8-10-19)23-21(26)14-16-6-11-20-17(13-16)12-15(3)22(27)24-20/h6-13H,4-5,14H2,1-3H3,(H,23,26)(H,24,27)

  It can provide a standard way to encode the molecular information of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide 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 N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide is:

  InChIKey=IIABSDDDTOQWSK-UHFFFAOYSA-N

  The InChIKey may allow easier web searches for N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide, but it needs to be linked to the full InChI to get back to the original structure of the N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide since the full standard InChI cannot be reconstructed from the InChIKey.

• Other names (synonyms) or registry numbers of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide

  The N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide compound may be named differently depending on the various situations of industrial applications. Other names (synonyms) of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide including the registry numbers are listed below, if available:

  
  
  None available.

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N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide Identification Summary Frequently Asked Questions (FAQs)

What’s the N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide formula?
C22H25N3O2
How many atoms and what elements are included in the N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide molecule?
52 atom(s) - 25 Hydrogen atom(s), 22 Carbon atom(s), 3 Nitrogen atom(s), and 2 Oxygen atom(s)
How many chemical bonds and what kind of bonds are in the N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide structure?
54 bond(s) - 29 non-H bond(s), 15 multiple bond(s), 6 rotatable bond(s), 3 double bond(s), 12 aromatic bond(s), 3 six-membered ring(s), 1 ten-membered ring(s), 2 secondary amide(s) (aliphatic), and 1 tertiary amine(s) (aromatic)
What’s the N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide’s molar mass?
363.4528 g/mol
What’s the SMILES structure of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide?
CCN(CC)c3ccc(NC(=O)Cc2ccc1[nH]c(=O)c(C)cc1c2)cc3
What’s the InChI code of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide?
InChI=1S/C22H25N3O2/c1-4-25(5-2)19-9-7-18(8-10-19)23-21(26)14-16-6-11-20-17(13-16)12-15(3)22(27)24-20/h6-13H,4-5,14H2,1-3H3,(H,23,26)(H,24,27)
What’s the InChIKey format of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide?
IIABSDDDTOQWSK-UHFFFAOYSA-N

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commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).