2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide

C23H28N2O5 — CID 108556308

IUPAC2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide
SMILESCCOc1ccc(OCC(=O)NC2CCN(C(=O)COc3ccccc3)CC2)cc1
InChIInChI=1S/C23H28N2O5/c1-2-28-20-8-10-21(11-9-20)29-16-22(26)24-18-12-14-25(15-13-18)23(27)17-30-19-6-4-3-5-7-19/h3-11,18H,2,12-17H2,1H3,(H,24,26)
InChIKeyZCAALMMMPPNXLE-UHFFFAOYSA-N
MW412.49 g/mol
LogP2.65
Rot. Bonds9

About 2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide

2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide (PubChem CID 108556308) has the molecular formula C23H28N2O5 and a molecular weight of 412.49 g/mol. Its IUPAC name is 2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide
PubChem CID108556308
Molecular FormulaC23H28N2O5
Molecular Weight412.49 g/mol
Exact Mass412.20
IUPAC Name2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide
SMILESCCOc1ccc(OCC(=O)NC2CCN(C(=O)COc3ccccc3)CC2)cc1
InChIInChI=1S/C23H28N2O5/c1-2-28-20-8-10-21(11-9-20)29-16-22(26)24-18-12-14-25(15-13-18)23(27)17-30-19-6-4-3-5-7-19/h3-11,18H,2,12-17H2,1H3,(H,24,26)
InChIKeyZCAALMMMPPNXLE-UHFFFAOYSA-N
XLogP2.65
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.49
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-phenylacetamide
CID 108551305
N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide
CID 108557001
2-(4-ethoxyphenyl)-N-[1-[2-(4-methylphenoxy)acetyl]piperidin-4-yl]acetamide
CID 108553966
N-[1-(4-chlorobutanoyl)piperidin-4-yl]-2-(4-ethoxyphenoxy)acetamide
CID 108562203
(E)-N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-3-phenylprop-2-enamide
CID 108566451
2-phenoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]acetamide
CID 108555833
ethyl 4-[[2-(4-phenylphenoxy)acetyl]amino]piperidine-1-carboxylate
CID 4009402
2-(4-ethoxyphenoxy)-N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]acetamide
CID 108556268
ethyl 4-[[2-(3-ethoxyphenoxy)acetyl]amino]piperidine-1-carboxylate
CID 112977740
N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2,2,2-trifluoroacetamide
CID 108548748
N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide
CID 108554067
N-[1-(3-phenylpropanoyl)piperidin-4-yl]-2-(4-propylphenoxy)acetamide
CID 108553098

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide (CID 108556308) is 2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide is CCOc1ccc(OCC(=O)NC2CCN(C(=O)COc3ccccc3)CC2)cc1.
What is the InChIKey of 2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide?
The InChIKey is ZCAALMMMPPNXLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O5/c1-2-28-20-8-10-21(11-9-20)29-16-22(26)24-18-12-14-25(15-13-18)23(27)17-30-19-6-4-3-5-7-19/h3-11,18H,2,12-17H2,1H3,(H,24,26).
What are the key properties of 2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide?
2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide has a molecular weight of 412.49 g/mol, XLogP of 2.65, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 108556308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).