N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide

C23H28N2O5 — CID 2961131

IUPACN-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide
SMILESCOc1ccc(OCCNC(=O)c2ccccc2OCC(=O)N2CCCCC2)cc1
InChIInChI=1S/C23H28N2O5/c1-28-18-9-11-19(12-10-18)29-16-13-24-23(27)20-7-3-4-8-21(20)30-17-22(26)25-14-5-2-6-15-25/h3-4,7-12H,2,5-6,13-17H2,1H3,(H,24,27)
InChIKeyQMJLWKAEMCPQHM-UHFFFAOYSA-N
MW412.49 g/mol
LogP2.90
Rot. Bonds9

About N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide

N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide (PubChem CID 2961131) has the molecular formula C23H28N2O5 and a molecular weight of 412.49 g/mol. Its IUPAC name is N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide
PubChem CID2961131
Molecular FormulaC23H28N2O5
Molecular Weight412.49 g/mol
Exact Mass412.20
IUPAC NameN-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide
SMILESCOc1ccc(OCCNC(=O)c2ccccc2OCC(=O)N2CCCCC2)cc1
InChIInChI=1S/C23H28N2O5/c1-28-18-9-11-19(12-10-18)29-16-13-24-23(27)20-7-3-4-8-21(20)30-17-22(26)25-14-5-2-6-15-25/h3-4,7-12H,2,5-6,13-17H2,1H3,(H,24,27)
InChIKeyQMJLWKAEMCPQHM-UHFFFAOYSA-N
XLogP2.90
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 ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide with MolForge

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

Launch Full Analysis

Related Compounds

Mersalyl Acid
CID 12358988
Mersalyl
CID 9806195
N-[3-(dimethylamino)propyl]-2-phenoxybenzamide
CID 1928169
AdipoRon
CID 16307093
(4-((4-Ethoxyphenoxy)methyl)phenyl)(3-methylpiperidin-1-yl)methanone
CID 2942250
1-[4-(2,3-Dimethoxybenzoyl)piperazin-1-yl]-2-(3-methylphenoxy)ethanone
CID 1072048
Tcmdc-123621
CID 2400619
2-{[3-(Piperazin-1-ylcarbonyl)phenyl]methoxy}benzamide
CID 25218485
2-{[4-Fluoro-3-(piperazin-1-ylcarbonyl)phenyl]methoxy}benzamide
CID 25218486
2-{2-[3-(Piperazin-1-ylcarbonyl)phenyl]ethoxy}benzamide
CID 25218489
5-Fluoro-2-{[4-fluoro-3-(piperazin-1-ylcarbonyl)phenyl]methoxy}benzamide
CID 25218495
2-Methoxy-N-(3-methyl-2-phenyl-butyl)-benzamide
CID 44270882

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide?
The IUPAC name of N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide (CID 2961131) is N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide.
What is the SMILES notation for N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide?
The canonical SMILES for N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide is COc1ccc(OCCNC(=O)c2ccccc2OCC(=O)N2CCCCC2)cc1.
What is the InChIKey of N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide?
The InChIKey is QMJLWKAEMCPQHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O5/c1-28-18-9-11-19(12-10-18)29-16-13-24-23(27)20-7-3-4-8-21(20)30-17-22(26)25-14-5-2-6-15-25/h3-4,7-12H,2,5-6,13-17H2,1H3,(H,24,27).
What are the key properties of N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide?
N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide has a molecular weight of 412.49 g/mol, XLogP of 2.90, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenoxy)ethyl]-2-(2-oxo-2-piperidin-1-ylethoxy)benzamide is sourced from PubChem (CID 2961131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).