2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide

C18H21N2OP — CID 142893266

IUPAC2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide
SMILESNC(=O)C(c1ccccc1)(c1ccccc1)C1CCN(P)C1
InChIInChI=1S/C18H21N2OP/c19-17(21)18(14-7-3-1-4-8-14,15-9-5-2-6-10-15)16-11-12-20(22)13-16/h1-10,16H,11-13,22H2,(H2,19,21)
InChIKeyGPWLWLAZYCDXPJ-UHFFFAOYSA-N
MW312.35 g/mol
LogP2.57
Rot. Bonds4

About 2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide

2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide (PubChem CID 142893266) has the molecular formula C18H21N2OP and a molecular weight of 312.35 g/mol. Its IUPAC name is 2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide.

Molecular Properties

Compound Name2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide
PubChem CID142893266
Molecular FormulaC18H21N2OP
Molecular Weight312.35 g/mol
Exact Mass312.14
IUPAC Name2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide
SMILESNC(=O)C(c1ccccc1)(c1ccccc1)C1CCN(P)C1
InChIInChI=1S/C18H21N2OP/c19-17(21)18(14-7-3-1-4-8-14,15-9-5-2-6-10-15)16-11-12-20(22)13-16/h1-10,16H,11-13,22H2,(H2,19,21)
InChIKeyGPWLWLAZYCDXPJ-UHFFFAOYSA-N
XLogP2.57
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.35
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[1-(2-aminoethyl)pyrrolidin-3-yl]-2,2-diphenylacetamide
CID 66858006
2-[(3S)-1-(7-oxoheptyl)pyrrolidin-3-yl]-2,2-diphenylacetamide;hydrochloride
CID 87396933
2-[(3R)-1-[7-(methylamino)heptyl]pyrrolidin-3-yl]-2,2-diphenylacetamide
CID 11600092
2-[(3R)-1-[2-(4-methylphenyl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide
CID 18654449
2-[(3S)-1-[4-[4-(2-hydroxyethyl)phenyl]butyl]pyrrolidin-3-yl]-2,2-diphenylacetamide
CID 66859566
2-[(3S)-1-[2-(4-acetylphenyl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide
CID 18654453
2-[1-[2-(4-cyanophenyl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide
CID 19007315
2-[1-[3-[4-[2-(methylamino)ethyl]phenyl]propyl]pyrrolidin-3-yl]-2,2-diphenylacetamide
CID 69036123
2-[(3R)-1-[8-(cyclobutylamino)octyl]pyrrolidin-3-yl]-2,2-diphenylacetamide
CID 11408589
2-[(3S)-1-[8-(cyclobutylamino)octyl]pyrrolidin-3-yl]-2,2-diphenylacetamide
CID 16755438
methyl 4-[2-[(3R)-3-(2-amino-2-oxo-1,1-diphenylethyl)pyrrolidin-1-yl]ethyl]benzoate
CID 54263266
2-[(3R)-1-[9-[[(2S)-1-hydroxypropan-2-yl]amino]nonyl]pyrrolidin-3-yl]-2,2-diphenylacetamide
CID 11306139

Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide?
The IUPAC name of 2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide (CID 142893266) is 2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide.
What is the SMILES notation for 2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide?
The canonical SMILES for 2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide is NC(=O)C(c1ccccc1)(c1ccccc1)C1CCN(P)C1.
What is the InChIKey of 2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide?
The InChIKey is GPWLWLAZYCDXPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N2OP/c19-17(21)18(14-7-3-1-4-8-14,15-9-5-2-6-10-15)16-11-12-20(22)13-16/h1-10,16H,11-13,22H2,(H2,19,21).
What are the key properties of 2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide?
2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide has a molecular weight of 312.35 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-2-(1-phosphanylpyrrolidin-3-yl)acetamide is sourced from PubChem (CID 142893266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).