morpholin-4-yl(triphenyl)phosphanium

C22H23NOP+ — CID 175307585

IUPACmorpholin-4-yl(triphenyl)phosphanium
SMILESc1ccc([P+](c2ccccc2)(c2ccccc2)N2CCOCC2)cc1
InChIInChI=1S/C22H23NOP/c1-4-10-20(11-5-1)25(21-12-6-2-7-13-21,22-14-8-3-9-15-22)23-16-18-24-19-17-23/h1-15H,16-19H2/q+1
InChIKeyKLVOUQYNDDPPHN-UHFFFAOYSA-N
MW348.41 g/mol
LogP3.23
Rot. Bonds4

About morpholin-4-yl(triphenyl)phosphanium

morpholin-4-yl(triphenyl)phosphanium (PubChem CID 175307585) has the molecular formula C22H23NOP+ and a molecular weight of 348.41 g/mol. Its IUPAC name is morpholin-4-yl(triphenyl)phosphanium.

Molecular Properties

Compound Namemorpholin-4-yl(triphenyl)phosphanium
PubChem CID175307585
Molecular FormulaC22H23NOP+
Molecular Weight348.41 g/mol
Exact Mass348.15
IUPAC Namemorpholin-4-yl(triphenyl)phosphanium
SMILESc1ccc([P+](c2ccccc2)(c2ccccc2)N2CCOCC2)cc1
InChIInChI=1S/C22H23NOP/c1-4-10-20(11-5-1)25(21-12-6-2-7-13-21,22-14-8-3-9-15-22)23-16-18-24-19-17-23/h1-15H,16-19H2/q+1
InChIKeyKLVOUQYNDDPPHN-UHFFFAOYSA-N
XLogP3.23
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl(triphenyl)phosphanium?
The IUPAC name of morpholin-4-yl(triphenyl)phosphanium (CID 175307585) is morpholin-4-yl(triphenyl)phosphanium.
What is the SMILES notation for morpholin-4-yl(triphenyl)phosphanium?
The canonical SMILES for morpholin-4-yl(triphenyl)phosphanium is c1ccc([P+](c2ccccc2)(c2ccccc2)N2CCOCC2)cc1.
What is the InChIKey of morpholin-4-yl(triphenyl)phosphanium?
The InChIKey is KLVOUQYNDDPPHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NOP/c1-4-10-20(11-5-1)25(21-12-6-2-7-13-21,22-14-8-3-9-15-22)23-16-18-24-19-17-23/h1-15H,16-19H2/q+1.
What are the key properties of morpholin-4-yl(triphenyl)phosphanium?
morpholin-4-yl(triphenyl)phosphanium has a molecular weight of 348.41 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl(triphenyl)phosphanium is sourced from PubChem (CID 175307585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).