4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide

C17H26N2O3 — CID 91918292

IUPAC4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide
SMILESCOCCOC1CCN(C(=O)NCCc2ccccc2)CC1
InChIInChI=1S/C17H26N2O3/c1-21-13-14-22-16-8-11-19(12-9-16)17(20)18-10-7-15-5-3-2-4-6-15/h2-6,16H,7-14H2,1H3,(H,18,20)
InChIKeyRALKNWYMZSCEHX-UHFFFAOYSA-N
MW306.41 g/mol
LogP2.07
Rot. Bonds7

About 4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide

4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide (PubChem CID 91918292) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is 4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide
PubChem CID91918292
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide
SMILESCOCCOC1CCN(C(=O)NCCc2ccccc2)CC1
InChIInChI=1S/C17H26N2O3/c1-21-13-14-22-16-8-11-19(12-9-16)17(20)18-10-7-15-5-3-2-4-6-15/h2-6,16H,7-14H2,1H3,(H,18,20)
InChIKeyRALKNWYMZSCEHX-UHFFFAOYSA-N
XLogP2.07
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide 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 4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide?
The IUPAC name of 4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide (CID 91918292) is 4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide?
The canonical SMILES for 4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide is COCCOC1CCN(C(=O)NCCc2ccccc2)CC1.
What is the InChIKey of 4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide?
The InChIKey is RALKNWYMZSCEHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-21-13-14-22-16-8-11-19(12-9-16)17(20)18-10-7-15-5-3-2-4-6-15/h2-6,16H,7-14H2,1H3,(H,18,20).
What are the key properties of 4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide?
4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide has a molecular weight of 306.41 g/mol, XLogP of 2.07, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethoxy)-N-(2-phenylethyl)piperidine-1-carboxamide is sourced from PubChem (CID 91918292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).