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

Chemical Formula of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide (C22H25N3O2)

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

2D chemical structure image of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide
Chemical Formula C22H25N3O2
Molecular Weight 363.4528 g/mol
IUPAC Name N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide
SMILES String CCN(CC)c3ccc(NC(=O)Cc2ccc1[nH]c(=O)c(C)cc1c2)cc3
InChI 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)
InChIKey IIABSDDDTOQWSK-UHFFFAOYSA-N

Chemical Formula Description

The N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide molecule contains a total of 52 atom(s). There are 25 Hydrogen atom(s), 22 Carbon atom(s), 3 Nitrogen atom(s) and 2 Oxygen atom(s). A chemical formula of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide can therefore be written as:

C22H25N3O2

The chemical formula of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide shown above is based on the molecular formula indicating the numbers of each type of atom in a molecule without structural information, which is different from the empirical formula which provides the numerical proportions of atoms of each type.

The above chemical formula is the basis of stoichiometry in chemical equations, i.e., the calculation of relative quantities of reactants and products in chemical reactions. The law of conservation of mass dictates that the quantity of each element given in the chemical formula does not change in a chemical reaction. Thus, each side of the chemical equation must represent the same quantity of any particular element based on the chemical formula.

Ball-and-stick model of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide
Ball-and-stick model of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide

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


  • InChI (IUPAC International Chemical Identifier) information of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide

    The molecular chemical formulas lack structural information. An alternative textual expression including the structural information 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 have different names depending on the various different situations of industrial applications. The list of the other names (synonyms) of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide including the registry numbers is given below, if available:



    None available.


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

What’s the chemical formula of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide?
C22H25N3O2
How many atoms and what are they in the N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide structure?
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 are they 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 molecular weight of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide?
363.4528 g/mol
What’s the SMILES string 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 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 of N-[4-(diethylamino)phenyl]-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide?
IIABSDDDTOQWSK-UHFFFAOYSA-N

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