N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide

C24H28N2O5 — CID 4884523

IUPACN-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide
SMILESCCOc1cc(C(=O)Nc2cccc(C(C)=O)c2)ccc1OCC(=O)N1CCCCC1
InChIInChI=1S/C24H28N2O5/c1-3-30-22-15-19(24(29)25-20-9-7-8-18(14-20)17(2)27)10-11-21(22)31-16-23(28)26-12-5-4-6-13-26/h7-11,14-15H,3-6,12-13,16H2,1-2H3,(H,25,29)
InChIKeyJNTWQSUPGAUEDK-UHFFFAOYSA-N
MW424.50 g/mol
LogP3.93
Rot. Bonds8

About N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide

N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide (PubChem CID 4884523) has the molecular formula C24H28N2O5 and a molecular weight of 424.50 g/mol. Its IUPAC name is N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide
PubChem CID4884523
Molecular FormulaC24H28N2O5
Molecular Weight424.50 g/mol
Exact Mass424.20
IUPAC NameN-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide
SMILESCCOc1cc(C(=O)Nc2cccc(C(C)=O)c2)ccc1OCC(=O)N1CCCCC1
InChIInChI=1S/C24H28N2O5/c1-3-30-22-15-19(24(29)25-20-9-7-8-18(14-20)17(2)27)10-11-21(22)31-16-23(28)26-12-5-4-6-13-26/h7-11,14-15H,3-6,12-13,16H2,1-2H3,(H,25,29)
InChIKeyJNTWQSUPGAUEDK-UHFFFAOYSA-N
XLogP3.93
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.50
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3-acetylphenyl)-3-ethoxy-4-(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

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide?
The IUPAC name of N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide (CID 4884523) is N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide.
What is the SMILES notation for N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide?
The canonical SMILES for N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide is CCOc1cc(C(=O)Nc2cccc(C(C)=O)c2)ccc1OCC(=O)N1CCCCC1.
What is the InChIKey of N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide?
The InChIKey is JNTWQSUPGAUEDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O5/c1-3-30-22-15-19(24(29)25-20-9-7-8-18(14-20)17(2)27)10-11-21(22)31-16-23(28)26-12-5-4-6-13-26/h7-11,14-15H,3-6,12-13,16H2,1-2H3,(H,25,29).
What are the key properties of N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide?
N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide has a molecular weight of 424.50 g/mol, XLogP of 3.93, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide is sourced from PubChem (CID 4884523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).