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Molecular Weight of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine (C20H27FN4O2)

Identification of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine Chemical Compound

2D chemical structure image of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine
Chemical Formula C20H27FN4O2
Molecular Weight 374.452383 g/mol
IUPAC Name 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine
SMILES String COCCN1C(C)CN(CC1C)C(=O)c3cc(c2ccc(F)cc2)n(C)n3
InChI InChI=1S/C20H27FN4O2/c1-14-12-24(13-15(2)25(14)9-10-27-4)20(26)18-11-19(23(3)22-18)16-5-7-17(21)8-6-16/h5-8,11,14-15H,9-10,12-13H2,1-4H3
InChIKey WSFVOGWTPNFFOO-UHFFFAOYSA-N

Molecular Weight Description

The 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine molecule consists of 27 Hydrogen atom(s), 20 Carbon atom(s), 4 Nitrogen atom(s), 2 Oxygen atom(s), and 1 Fluorine atom(s) - a total of 54 atom(s). The molecular weight of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine is determined by the sum of the atomic weights of each constituent element multiplied by the number of atoms, which is calculated to be:

$$ 374.452383 · \frac{g}{mol} $$

The exact term of the above molecular weight is “molar mass”, which is based on the atomic mass of each element. Molecular weight is actually an older term of “relative molar mass” or “molecular mass”, which is a dimensionless quantity equal to the molar mass divided by the molar mass constant defined by 1 g/mol.

Molecular masses are calculated from the standard atomic weights of each nuclide, while molar masses are calculated from the atomic mass of each element. The atomic mass takes into account the isotopic distribution of the element in a given sample.

3D chemical structure image of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine
Ball-and-stick model of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine

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Additional Information for Identifying 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine Molecule

  • InChI (IUPAC International Chemical Identifier) information of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine

    In addition to the molecular weight information, the structural information of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine in a textual expression is available via InChi. The full standard InChI of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine is given below:

    InChI=1S/C20H27FN4O2/c1-14-12-24(13-15(2)25(14)9-10-27-4)20(26)18-11-19(23(3)22-18)16-5-7-17(21)8-6-16/h5-8,11,14-15H,9-10,12-13H2,1-4H3

    It can provide a way to encode the molecular information of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine 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 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine is:

    InChIKey=WSFVOGWTPNFFOO-UHFFFAOYSA-N

    It may allow easier web searches for 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine. The InChIKey, however, needs to be linked to the full InChI as well in order to get back to the original structure of the 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine as the full standard InChI cannot be reconstructed from the InChIKey.

  • Other names (synonyms) or registry numbers of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine

    There may be different names of the 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine compound depending on the various situations of industrial applications, which are given below including the registry numbers if available:



    None available.

4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine Identification Summary Frequently Asked Questions (FAQs)

What’s the formula of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine?
C20H27FN4O2
How many atoms and what are the elements in the 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine molecule?
54 atom(s) - 27 Hydrogen atom(s), 20 Carbon atom(s), 4 Nitrogen atom(s), 2 Oxygen atom(s), and 1 Fluorine atom(s)
How many chemical bonds and what types of bonds are in the 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine structure?
56 bond(s) - 29 non-H bond(s), 12 multiple bond(s), 5 rotatable bond(s), 1 double bond(s), 11 aromatic bond(s), 1 five-membered ring(s), 2 six-membered ring(s), 1 tertiary amide(s) (aromatic), 1 tertiary amine(s) (aliphatic), 1 ether(s) (aliphatic), and 1 Pyrazole(s)
What’s the molar mass of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine?
374.452383 g/mol
What’s the SMILES format of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine?
COCCN1C(C)CN(CC1C)C(=O)c3cc(c2ccc(F)cc2)n(C)n3
What’s the InChI format of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine?
InChI=1S/C20H27FN4O2/c1-14-12-24(13-15(2)25(14)9-10-27-4)20(26)18-11-19(23(3)22-18)16-5-7-17(21)8-6-16/h5-8,11,14-15H,9-10,12-13H2,1-4H3
What’s the InChIKey string of 4-{[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yl]carbonyl}-1-(2-methoxyethyl)-2,6-dimethylpiperazine?
WSFVOGWTPNFFOO-UHFFFAOYSA-N

29 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).

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