diethyl-(2-piperidin-4-ylphenyl)phosphane

C15H24NP — CID 174429999

IUPACdiethyl-(2-piperidin-4-ylphenyl)phosphane
SMILESCCP(CC)c1ccccc1C1CCNCC1
InChIInChI=1S/C15H24NP/c1-3-17(4-2)15-8-6-5-7-14(15)13-9-11-16-12-10-13/h5-8,13,16H,3-4,9-12H2,1-2H3
InChIKeyMYPHRAKLTFBQPE-UHFFFAOYSA-N
MW249.34 g/mol
LogP3.30
Rot. Bonds4

About diethyl-(2-piperidin-4-ylphenyl)phosphane

diethyl-(2-piperidin-4-ylphenyl)phosphane (PubChem CID 174429999) has the molecular formula C15H24NP and a molecular weight of 249.34 g/mol. Its IUPAC name is diethyl-(2-piperidin-4-ylphenyl)phosphane.

Molecular Properties

Compound Namediethyl-(2-piperidin-4-ylphenyl)phosphane
PubChem CID174429999
Molecular FormulaC15H24NP
Molecular Weight249.34 g/mol
Exact Mass249.16
IUPAC Namediethyl-(2-piperidin-4-ylphenyl)phosphane
SMILESCCP(CC)c1ccccc1C1CCNCC1
InChIInChI=1S/C15H24NP/c1-3-17(4-2)15-8-6-5-7-14(15)13-9-11-16-12-10-13/h5-8,13,16H,3-4,9-12H2,1-2H3
InChIKeyMYPHRAKLTFBQPE-UHFFFAOYSA-N
XLogP3.30
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of diethyl-(2-piperidin-4-ylphenyl)phosphane?
The IUPAC name of diethyl-(2-piperidin-4-ylphenyl)phosphane (CID 174429999) is diethyl-(2-piperidin-4-ylphenyl)phosphane.
What is the SMILES notation for diethyl-(2-piperidin-4-ylphenyl)phosphane?
The canonical SMILES for diethyl-(2-piperidin-4-ylphenyl)phosphane is CCP(CC)c1ccccc1C1CCNCC1.
What is the InChIKey of diethyl-(2-piperidin-4-ylphenyl)phosphane?
The InChIKey is MYPHRAKLTFBQPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24NP/c1-3-17(4-2)15-8-6-5-7-14(15)13-9-11-16-12-10-13/h5-8,13,16H,3-4,9-12H2,1-2H3.
What are the key properties of diethyl-(2-piperidin-4-ylphenyl)phosphane?
diethyl-(2-piperidin-4-ylphenyl)phosphane has a molecular weight of 249.34 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-(2-piperidin-4-ylphenyl)phosphane is sourced from PubChem (CID 174429999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).