2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide

C26H34N2O4 — CID 108557069

IUPAC2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide
SMILESCCCc1ccc(OCC(=O)N2CCC(NC(=O)COc3ccccc3CC)CC2)cc1
InChIInChI=1S/C26H34N2O4/c1-3-7-20-10-12-23(13-11-20)31-19-26(30)28-16-14-22(15-17-28)27-25(29)18-32-24-9-6-5-8-21(24)4-2/h5-6,8-13,22H,3-4,7,14-19H2,1-2H3,(H,27,29)
InChIKeyWRSINHSSYNIKIC-UHFFFAOYSA-N
MW438.57 g/mol
LogP3.77
Rot. Bonds10

About 2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide

2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide (PubChem CID 108557069) has the molecular formula C26H34N2O4 and a molecular weight of 438.57 g/mol. Its IUPAC name is 2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide
PubChem CID108557069
Molecular FormulaC26H34N2O4
Molecular Weight438.57 g/mol
Exact Mass438.25
IUPAC Name2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide
SMILESCCCc1ccc(OCC(=O)N2CCC(NC(=O)COc3ccccc3CC)CC2)cc1
InChIInChI=1S/C26H34N2O4/c1-3-7-20-10-12-23(13-11-20)31-19-26(30)28-16-14-22(15-17-28)27-25(29)18-32-24-9-6-5-8-21(24)4-2/h5-6,8-13,22H,3-4,7,14-19H2,1-2H3,(H,27,29)
InChIKeyWRSINHSSYNIKIC-UHFFFAOYSA-N
XLogP3.77
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.57
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide
CID 108556685
N-[1-(3-phenylpropanoyl)piperidin-4-yl]-2-(4-propylphenoxy)acetamide
CID 108553098
4-oxo-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]pentanamide
CID 108558056
N-[1-(2-cyanoacetyl)piperidin-4-yl]-2-(2-ethylphenoxy)acetamide
CID 108557028
N-[1-[2-(2-ethylphenoxy)acetyl]piperidin-4-yl]-3-methoxypropanamide
CID 108556239
methyl N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]carbamate
CID 108565166
N-[2-oxo-2-[[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]amino]ethyl]benzamide
CID 108550430
2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide
CID 108556308
N-[1-(2-chlorobenzoyl)piperidin-4-yl]-2-(4-propylphenoxy)acetamide
CID 108553068
3-cyclohexyl-N-[1-[2-(2-ethylphenoxy)acetyl]piperidin-4-yl]propanamide
CID 108555743
2-ethyl-N-[1-[2-(2-ethylphenoxy)acetyl]piperidin-4-yl]butanamide
CID 108555635
N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-phenylacetamide
CID 108551305

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide?
The IUPAC name of 2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide (CID 108557069) is 2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide.
What is the SMILES notation for 2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide?
The canonical SMILES for 2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide is CCCc1ccc(OCC(=O)N2CCC(NC(=O)COc3ccccc3CC)CC2)cc1.
What is the InChIKey of 2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide?
The InChIKey is WRSINHSSYNIKIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34N2O4/c1-3-7-20-10-12-23(13-11-20)31-19-26(30)28-16-14-22(15-17-28)27-25(29)18-32-24-9-6-5-8-21(24)4-2/h5-6,8-13,22H,3-4,7,14-19H2,1-2H3,(H,27,29).
What are the key properties of 2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide?
2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide has a molecular weight of 438.57 g/mol, XLogP of 3.77, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylphenoxy)-N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 108557069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).