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

C24H30N2O5 — CID 108557001

IUPACN-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide
SMILESCCOc1ccc(OCC(=O)N2CCC(NC(=O)COc3ccc(C)cc3)CC2)cc1
InChIInChI=1S/C24H30N2O5/c1-3-29-20-8-10-22(11-9-20)31-17-24(28)26-14-12-19(13-15-26)25-23(27)16-30-21-6-4-18(2)5-7-21/h4-11,19H,3,12-17H2,1-2H3,(H,25,27)
InChIKeyITOKOSDIFDGREM-UHFFFAOYSA-N
MW426.51 g/mol
LogP2.96
Rot. Bonds9

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

N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide (PubChem CID 108557001) has the molecular formula C24H30N2O5 and a molecular weight of 426.51 g/mol. Its IUPAC name is N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide
PubChem CID108557001
Molecular FormulaC24H30N2O5
Molecular Weight426.51 g/mol
Exact Mass426.22
IUPAC NameN-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide
SMILESCCOc1ccc(OCC(=O)N2CCC(NC(=O)COc3ccc(C)cc3)CC2)cc1
InChIInChI=1S/C24H30N2O5/c1-3-29-20-8-10-22(11-9-20)31-17-24(28)26-14-12-19(13-15-26)25-23(27)16-30-21-6-4-18(2)5-7-21/h4-11,19H,3,12-17H2,1-2H3,(H,25,27)
InChIKeyITOKOSDIFDGREM-UHFFFAOYSA-N
XLogP2.96
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.51
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-ethoxyphenyl)-N-[1-[2-(4-methylphenoxy)acetyl]piperidin-4-yl]acetamide
CID 108553966
2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide
CID 108556308
4-ethoxy-N-[1-[2-(4-methylphenoxy)acetyl]piperidin-4-yl]benzamide
CID 108551924
2-(2,4-dimethylphenoxy)-N-[1-[2-(4-methylphenoxy)acetyl]piperidin-4-yl]acetamide
CID 108551105
N-[1-[2-(4-methylphenoxy)acetyl]piperidin-4-yl]-2-(2,3,6-trimethylphenoxy)acetamide
CID 108553275
N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-phenylacetamide
CID 108551305
N-[1-(4-chlorobutanoyl)piperidin-4-yl]-2-(4-ethoxyphenoxy)acetamide
CID 108562203
1-[4-[2-(4-ethoxyphenoxy)acetyl]piperazin-1-yl]-2-(4-methylphenoxy)ethanone
CID 108536873
N-[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide
CID 108556941
2-(4-ethoxyphenoxy)-N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]acetamide
CID 108556268
2,2,2-trifluoro-N-[1-[2-(4-methylphenoxy)acetyl]piperidin-4-yl]acetamide
CID 108548756
N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2,2,2-trifluoroacetamide
CID 108548748

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide?
The IUPAC name of N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide (CID 108557001) is N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide.
What is the SMILES notation for N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide?
The canonical SMILES for N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide is CCOc1ccc(OCC(=O)N2CCC(NC(=O)COc3ccc(C)cc3)CC2)cc1.
What is the InChIKey of N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide?
The InChIKey is ITOKOSDIFDGREM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O5/c1-3-29-20-8-10-22(11-9-20)31-17-24(28)26-14-12-19(13-15-26)25-23(27)16-30-21-6-4-18(2)5-7-21/h4-11,19H,3,12-17H2,1-2H3,(H,25,27).
What are the key properties of N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide?
N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide has a molecular weight of 426.51 g/mol, XLogP of 2.96, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide is sourced from PubChem (CID 108557001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).