[(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium

C24H24FNOP+ — CID 11214856

IUPAC[(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium
SMILESF/C(=C\[P+](c1ccccc1)(c1ccccc1)c1ccccc1)N1CCOCC1
InChIInChI=1S/C24H24FNOP/c25-24(26-16-18-27-19-17-26)20-28(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,20H,16-19H2/q+1/b24-20+
InChIKeyCEOZUTHFONPGJE-HIXSDJFHSA-N
MW392.43 g/mol
LogP4.08
Rot. Bonds5

About [(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium

[(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium (PubChem CID 11214856) has the molecular formula C24H24FNOP+ and a molecular weight of 392.43 g/mol. Its IUPAC name is [(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium.

Molecular Properties

Compound Name[(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium
PubChem CID11214856
Molecular FormulaC24H24FNOP+
Molecular Weight392.43 g/mol
Exact Mass392.16
IUPAC Name[(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium
SMILESF/C(=C\[P+](c1ccccc1)(c1ccccc1)c1ccccc1)N1CCOCC1
InChIInChI=1S/C24H24FNOP/c25-24(26-16-18-27-19-17-26)20-28(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,20H,16-19H2/q+1/b24-20+
InChIKeyCEOZUTHFONPGJE-HIXSDJFHSA-N
XLogP4.08
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.43
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium?
The IUPAC name of [(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium (CID 11214856) is [(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium.
What is the SMILES notation for [(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium?
The canonical SMILES for [(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium is F/C(=C\[P+](c1ccccc1)(c1ccccc1)c1ccccc1)N1CCOCC1.
What is the InChIKey of [(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium?
The InChIKey is CEOZUTHFONPGJE-HIXSDJFHSA-N. The full InChI is InChI=1S/C24H24FNOP/c25-24(26-16-18-27-19-17-26)20-28(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,20H,16-19H2/q+1/b24-20+.
What are the key properties of [(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium?
[(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium has a molecular weight of 392.43 g/mol, XLogP of 4.08, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-2-fluoro-2-morpholin-4-ylethenyl]-triphenylphosphanium is sourced from PubChem (CID 11214856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).