5-diphenylphosphoryl-N-ethylpentanamide

C19H24NO2P — CID 169437460

IUPAC5-diphenylphosphoryl-N-ethylpentanamide
SMILESCCNC(=O)CCCCP(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H24NO2P/c1-2-20-19(21)15-9-10-16-23(22,17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3-8,11-14H,2,9-10,15-16H2,1H3,(H,20,21)
InChIKeyBFKWSAKMELLVJB-UHFFFAOYSA-N
MW329.38 g/mol
LogP3.31
Rot. Bonds8

About 5-diphenylphosphoryl-N-ethylpentanamide

5-diphenylphosphoryl-N-ethylpentanamide (PubChem CID 169437460) has the molecular formula C19H24NO2P and a molecular weight of 329.38 g/mol. Its IUPAC name is 5-diphenylphosphoryl-N-ethylpentanamide.

Molecular Properties

Compound Name5-diphenylphosphoryl-N-ethylpentanamide
PubChem CID169437460
Molecular FormulaC19H24NO2P
Molecular Weight329.38 g/mol
Exact Mass329.15
IUPAC Name5-diphenylphosphoryl-N-ethylpentanamide
SMILESCCNC(=O)CCCCP(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H24NO2P/c1-2-20-19(21)15-9-10-16-23(22,17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3-8,11-14H,2,9-10,15-16H2,1H3,(H,20,21)
InChIKeyBFKWSAKMELLVJB-UHFFFAOYSA-N
XLogP3.31
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-diphenylphosphoryl-N-ethylpentanamide?
The IUPAC name of 5-diphenylphosphoryl-N-ethylpentanamide (CID 169437460) is 5-diphenylphosphoryl-N-ethylpentanamide.
What is the SMILES notation for 5-diphenylphosphoryl-N-ethylpentanamide?
The canonical SMILES for 5-diphenylphosphoryl-N-ethylpentanamide is CCNC(=O)CCCCP(=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 5-diphenylphosphoryl-N-ethylpentanamide?
The InChIKey is BFKWSAKMELLVJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24NO2P/c1-2-20-19(21)15-9-10-16-23(22,17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3-8,11-14H,2,9-10,15-16H2,1H3,(H,20,21).
What are the key properties of 5-diphenylphosphoryl-N-ethylpentanamide?
5-diphenylphosphoryl-N-ethylpentanamide has a molecular weight of 329.38 g/mol, XLogP of 3.31, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-diphenylphosphoryl-N-ethylpentanamide is sourced from PubChem (CID 169437460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).