2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide

C22H28N2O2 — CID 3047311

IUPAC2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide
SMILESCCOC(C(=O)NCCN1CCCC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H28N2O2/c1-2-26-22(19-11-5-3-6-12-19,20-13-7-4-8-14-20)21(25)23-15-18-24-16-9-10-17-24/h3-8,11-14H,2,9-10,15-18H2,1H3,(H,23,25)
InChIKeyMYWPJSNPKXNPSJ-UHFFFAOYSA-N
MW352.48 g/mol
LogP3.18
Rot. Bonds8

About 2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide

2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide (PubChem CID 3047311) has the molecular formula C22H28N2O2 and a molecular weight of 352.48 g/mol. Its IUPAC name is 2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide
PubChem CID3047311
Molecular FormulaC22H28N2O2
Molecular Weight352.48 g/mol
Exact Mass352.22
IUPAC Name2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide
SMILESCCOC(C(=O)NCCN1CCCC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H28N2O2/c1-2-26-22(19-11-5-3-6-12-19,20-13-7-4-8-14-20)21(25)23-15-18-24-16-9-10-17-24/h3-8,11-14H,2,9-10,15-18H2,1H3,(H,23,25)
InChIKeyMYWPJSNPKXNPSJ-UHFFFAOYSA-N
XLogP3.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Carbiphene
CID 10080
N-((1-Ethyl-2-pyrrolidinyl)methyl)-alpha-hydroxy-alpha-phenylbenzeneacetamide
CID 68862
N-[2-(Benzyloxy)ethyl]-2,2-diphenylacetamide
CID 597400
Benzeneacetamide, alpha-ethoxy-N-methyl-N-(2-(methyl(2-phenylethyl)amino)ethyl)-alpha-phenyl-, hydrochloride (1:1)
CID 10079
[2-(Cyclohexylamino)-1-(2-fluorophenyl)-2-oxoethyl] acetate
CID 3230480
[2-(Cyclohexylamino)-1-(3-fluorophenyl)-2-oxoethyl] acetate
CID 3230481
N-[2-(benzyloxy)ethyl]-3,3-diphenylpropanamide
CID 6456612
N-cyclooctyl-2-methoxy-2-phenylacetamide
CID 2921709
N-(2-{2-[Bis-(4-fluoro-phenyl)-methoxy]-ethylamino}-ethyl)-2-(4-fluoro-phenyl)-acetamide
CID 9980795
N-(2-{2-[Bis-(4-fluoro-phenyl)-methoxy]-ethylamino}-ethyl)-2-phenyl-acetamide
CID 10788455
Ammonium, (2-(benziloylamino)ethyl)diethylmethyl-, iodide
CID 59252
Acetic acid cyclohexylcarbamoyl-p-tolyl-methyl ester
CID 651616

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide?
The IUPAC name of 2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide (CID 3047311) is 2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide.
What is the SMILES notation for 2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide?
The canonical SMILES for 2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide is CCOC(C(=O)NCCN1CCCC1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide?
The InChIKey is MYWPJSNPKXNPSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O2/c1-2-26-22(19-11-5-3-6-12-19,20-13-7-4-8-14-20)21(25)23-15-18-24-16-9-10-17-24/h3-8,11-14H,2,9-10,15-18H2,1H3,(H,23,25).
What are the key properties of 2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide?
2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide has a molecular weight of 352.48 g/mol, XLogP of 3.18, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2,2-diphenyl-N-(2-pyrrolidin-1-ylethyl)acetamide is sourced from PubChem (CID 3047311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).