2-diphenylphosphoryl-N,N-diethylpropanamide

C19H24NO2P — CID 14897367

IUPAC2-diphenylphosphoryl-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)P(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H24NO2P/c1-4-20(5-2)19(21)16(3)23(22,17-12-8-6-9-13-17)18-14-10-7-11-15-18/h6-16H,4-5H2,1-3H3
InChIKeyBZAQEINCHHFKGF-UHFFFAOYSA-N
MW329.38 g/mol
LogP3.26
Rot. Bonds6

About 2-diphenylphosphoryl-N,N-diethylpropanamide

2-diphenylphosphoryl-N,N-diethylpropanamide (PubChem CID 14897367) has the molecular formula C19H24NO2P and a molecular weight of 329.38 g/mol. Its IUPAC name is 2-diphenylphosphoryl-N,N-diethylpropanamide.

Molecular Properties

Compound Name2-diphenylphosphoryl-N,N-diethylpropanamide
PubChem CID14897367
Molecular FormulaC19H24NO2P
Molecular Weight329.38 g/mol
Exact Mass329.15
IUPAC Name2-diphenylphosphoryl-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)P(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H24NO2P/c1-4-20(5-2)19(21)16(3)23(22,17-12-8-6-9-13-17)18-14-10-7-11-15-18/h6-16H,4-5H2,1-3H3
InChIKeyBZAQEINCHHFKGF-UHFFFAOYSA-N
XLogP3.26
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(diphenylphosphoryl)-N,N-diethylethanamine
CID 785453
3-(diethylamino)-2-(diphenylphosphoryl)-N,N-diethylpropanamide
CID 2879771
octyl(phenyl)-N,N-diisobutylcarbamoylmethylphosphine oxide
CID 158335
Acetamide, 2-(diphenylphosphinyl)-N-ethyl-
CID 796967
1-(diphenylphosphoryl)-N,N-diethylcyclobutanecarboxamide
CID 1046768
2-Diphenylphosphoryl-1-morpholin-4-ylethanone
CID 608571
Acetamide, 2-(diphenylphosphinyl)-N,N-diethyl-
CID 796632
3-(Diphenylphosphoryl)-N,N-dimethylpropan-1-amine
CID 120484
2-(diphenylphosphoryl)-N,N-dipropylacetamide
CID 2193730
6-(diphenylphosphoryl)-1,3-dimethyldihydro-2,4(1H,3H)-pyrimidinedione
CID 2828354
N,N-dibutyl-1-(diphenylphosphoryl)cyclobutanecarboxamide
CID 1909338
N,N-diethyl-2-[phenyl(propyl)phosphoryl]acetamide
CID 2241619

Frequently Asked Questions

What is the IUPAC name of 2-diphenylphosphoryl-N,N-diethylpropanamide?
The IUPAC name of 2-diphenylphosphoryl-N,N-diethylpropanamide (CID 14897367) is 2-diphenylphosphoryl-N,N-diethylpropanamide.
What is the SMILES notation for 2-diphenylphosphoryl-N,N-diethylpropanamide?
The canonical SMILES for 2-diphenylphosphoryl-N,N-diethylpropanamide is CCN(CC)C(=O)C(C)P(=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-diphenylphosphoryl-N,N-diethylpropanamide?
The InChIKey is BZAQEINCHHFKGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24NO2P/c1-4-20(5-2)19(21)16(3)23(22,17-12-8-6-9-13-17)18-14-10-7-11-15-18/h6-16H,4-5H2,1-3H3.
What are the key properties of 2-diphenylphosphoryl-N,N-diethylpropanamide?
2-diphenylphosphoryl-N,N-diethylpropanamide has a molecular weight of 329.38 g/mol, XLogP of 3.26, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylphosphoryl-N,N-diethylpropanamide is sourced from PubChem (CID 14897367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).