[2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane

C24H26NOP — CID 145030339

IUPAC[2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane
SMILESCC1CN(c2ccccc2P(c2ccccc2)c2ccccc2)CC(C)O1
InChIInChI=1S/C24H26NOP/c1-19-17-25(18-20(2)26-19)23-15-9-10-16-24(23)27(21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-16,19-20H,17-18H2,1-2H3
InChIKeyJEUPEVLJOQCLLM-UHFFFAOYSA-N
MW375.45 g/mol
LogP4.06
Rot. Bonds4

About [2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane

[2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane (PubChem CID 145030339) has the molecular formula C24H26NOP and a molecular weight of 375.45 g/mol. Its IUPAC name is [2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane.

Molecular Properties

Compound Name[2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane
PubChem CID145030339
Molecular FormulaC24H26NOP
Molecular Weight375.45 g/mol
Exact Mass375.18
IUPAC Name[2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane
SMILESCC1CN(c2ccccc2P(c2ccccc2)c2ccccc2)CC(C)O1
InChIInChI=1S/C24H26NOP/c1-19-17-25(18-20(2)26-19)23-15-9-10-16-24(23)27(21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-16,19-20H,17-18H2,1-2H3
InChIKeyJEUPEVLJOQCLLM-UHFFFAOYSA-N
XLogP4.06
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.45
LogP ≤ 54.06
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 [2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane?
The IUPAC name of [2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane (CID 145030339) is [2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane.
What is the SMILES notation for [2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane?
The canonical SMILES for [2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane is CC1CN(c2ccccc2P(c2ccccc2)c2ccccc2)CC(C)O1.
What is the InChIKey of [2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane?
The InChIKey is JEUPEVLJOQCLLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26NOP/c1-19-17-25(18-20(2)26-19)23-15-9-10-16-24(23)27(21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-16,19-20H,17-18H2,1-2H3.
What are the key properties of [2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane?
[2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane has a molecular weight of 375.45 g/mol, XLogP of 4.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,6-dimethylmorpholin-4-yl)phenyl]-diphenylphosphane is sourced from PubChem (CID 145030339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).