2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone

C15H21NO3 — CID 61381248

IUPAC2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone
SMILESCCOCC(=O)N1CCC(Oc2ccccc2)CC1
InChIInChI=1S/C15H21NO3/c1-2-18-12-15(17)16-10-8-14(9-11-16)19-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3
InChIKeyGUIWLCMRENRAGP-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.09
Rot. Bonds5

About 2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone

2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone (PubChem CID 61381248) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone
PubChem CID61381248
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone
SMILESCCOCC(=O)N1CCC(Oc2ccccc2)CC1
InChIInChI=1S/C15H21NO3/c1-2-18-12-15(17)16-10-8-14(9-11-16)19-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3
InChIKeyGUIWLCMRENRAGP-UHFFFAOYSA-N
XLogP2.09
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone?
The IUPAC name of 2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone (CID 61381248) is 2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone.
What is the SMILES notation for 2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone?
The canonical SMILES for 2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone is CCOCC(=O)N1CCC(Oc2ccccc2)CC1.
What is the InChIKey of 2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone?
The InChIKey is GUIWLCMRENRAGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-2-18-12-15(17)16-10-8-14(9-11-16)19-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3.
What are the key properties of 2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone?
2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone has a molecular weight of 263.34 g/mol, XLogP of 2.09, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone is sourced from PubChem (CID 61381248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).