4-(2-diethylphosphorylphenyl)piperidine

C15H24NOP — CID 141020642

IUPAC4-(2-diethylphosphorylphenyl)piperidine
SMILESCCP(=O)(CC)c1ccccc1C1CCNCC1
InChIInChI=1S/C15H24NOP/c1-3-18(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
InChIKeyHLAUVDAXNMCNBW-UHFFFAOYSA-N
MW265.34 g/mol
LogP3.18
Rot. Bonds4

About 4-(2-diethylphosphorylphenyl)piperidine

4-(2-diethylphosphorylphenyl)piperidine (PubChem CID 141020642) has the molecular formula C15H24NOP and a molecular weight of 265.34 g/mol. Its IUPAC name is 4-(2-diethylphosphorylphenyl)piperidine.

Molecular Properties

Compound Name4-(2-diethylphosphorylphenyl)piperidine
PubChem CID141020642
Molecular FormulaC15H24NOP
Molecular Weight265.34 g/mol
Exact Mass265.16
IUPAC Name4-(2-diethylphosphorylphenyl)piperidine
SMILESCCP(=O)(CC)c1ccccc1C1CCNCC1
InChIInChI=1S/C15H24NOP/c1-3-18(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
InChIKeyHLAUVDAXNMCNBW-UHFFFAOYSA-N
XLogP3.18
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.34
LogP ≤ 53.18
H-Bond Donors ≤ 51
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 4-(2-diethylphosphorylphenyl)piperidine?
The IUPAC name of 4-(2-diethylphosphorylphenyl)piperidine (CID 141020642) is 4-(2-diethylphosphorylphenyl)piperidine.
What is the SMILES notation for 4-(2-diethylphosphorylphenyl)piperidine?
The canonical SMILES for 4-(2-diethylphosphorylphenyl)piperidine is CCP(=O)(CC)c1ccccc1C1CCNCC1.
What is the InChIKey of 4-(2-diethylphosphorylphenyl)piperidine?
The InChIKey is HLAUVDAXNMCNBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24NOP/c1-3-18(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 4-(2-diethylphosphorylphenyl)piperidine?
4-(2-diethylphosphorylphenyl)piperidine has a molecular weight of 265.34 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-diethylphosphorylphenyl)piperidine is sourced from PubChem (CID 141020642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).