2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide

C23H28N2O3 — CID 56715324

IUPAC2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide
SMILESCC(=O)c1ccc(OCC(=O)NC2CCCN(CCc3ccccc3)C2)cc1
InChIInChI=1S/C23H28N2O3/c1-18(26)20-9-11-22(12-10-20)28-17-23(27)24-21-8-5-14-25(16-21)15-13-19-6-3-2-4-7-19/h2-4,6-7,9-12,21H,5,8,13-17H2,1H3,(H,24,27)
InChIKeyBJEDWAQDBLBXKB-UHFFFAOYSA-N
MW380.49 g/mol
LogP3.09
Rot. Bonds8

About 2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide

2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide (PubChem CID 56715324) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is 2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide.

Molecular Properties

Compound Name2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide
PubChem CID56715324
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC Name2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide
SMILESCC(=O)c1ccc(OCC(=O)NC2CCCN(CCc3ccccc3)C2)cc1
InChIInChI=1S/C23H28N2O3/c1-18(26)20-9-11-22(12-10-20)28-17-23(27)24-21-8-5-14-25(16-21)15-13-19-6-3-2-4-7-19/h2-4,6-7,9-12,21H,5,8,13-17H2,1H3,(H,24,27)
InChIKeyBJEDWAQDBLBXKB-UHFFFAOYSA-N
XLogP3.09
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide
CID 56853055
2-(4-aminophenoxy)-N-(1-benzylpiperidin-3-yl)acetamide
CID 113239292
1-[(4aR,8aS)-6-(2-phenylethyl)-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-1-yl]-2-(4-acetylphenoxy)ethanone
CID 42482748
2-(4-acetylphenoxy)-N-cyclohexylacetamide
CID 2621514
N-[1-(3-phenylpropyl)piperidin-3-yl]acetamide
CID 171328429
4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide
CID 45196763
2-(2-oxopyrrolidin-1-yl)-N-[(3R)-1-(2-phenylethyl)piperidin-3-yl]acetamide
CID 25366353
2-(4-acetyl-3,5-dimethylpyrazol-1-yl)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide
CID 45252270
3,4,5-trimethoxy-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide
CID 45205527
N-[(3S)-1-(2-phenylethyl)piperidin-3-yl]pyridine-4-carboxamide
CID 25460236
N-[1-(2-phenylethyl)piperidin-3-yl]-3-pyridin-2-ylpropanamide
CID 45227413
N-[(3R)-1-(2-phenylethyl)piperidin-3-yl]-2-pyridin-2-ylsulfanylacetamide
CID 26403604

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide?
The IUPAC name of 2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide (CID 56715324) is 2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide.
What is the SMILES notation for 2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide?
The canonical SMILES for 2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide is CC(=O)c1ccc(OCC(=O)NC2CCCN(CCc3ccccc3)C2)cc1.
What is the InChIKey of 2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide?
The InChIKey is BJEDWAQDBLBXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-18(26)20-9-11-22(12-10-20)28-17-23(27)24-21-8-5-14-25(16-21)15-13-19-6-3-2-4-7-19/h2-4,6-7,9-12,21H,5,8,13-17H2,1H3,(H,24,27).
What are the key properties of 2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide?
2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide has a molecular weight of 380.49 g/mol, XLogP of 3.09, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide is sourced from PubChem (CID 56715324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).