2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide

C21H30N4O3 — CID 46981067

IUPAC2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide
SMILESO=C(CN1CCN(C2CCCC2)C(=O)C1)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C21H30N4O3/c26-20(15-23-9-10-25(21(27)16-23)17-5-1-2-6-17)22-18-7-3-4-8-19(18)24-11-13-28-14-12-24/h3-4,7-8,17H,1-2,5-6,9-16H2,(H,22,26)
InChIKeyZEZZXZIJDOJGBI-UHFFFAOYSA-N
MW386.50 g/mol
LogP1.55
Rot. Bonds5

About 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide

2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide (PubChem CID 46981067) has the molecular formula C21H30N4O3 and a molecular weight of 386.50 g/mol. Its IUPAC name is 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide
PubChem CID46981067
Molecular FormulaC21H30N4O3
Molecular Weight386.50 g/mol
Exact Mass386.23
IUPAC Name2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide
SMILESO=C(CN1CCN(C2CCCC2)C(=O)C1)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C21H30N4O3/c26-20(15-23-9-10-25(21(27)16-23)17-5-1-2-6-17)22-18-7-3-4-8-19(18)24-11-13-28-14-12-24/h3-4,7-8,17H,1-2,5-6,9-16H2,(H,22,26)
InChIKeyZEZZXZIJDOJGBI-UHFFFAOYSA-N
XLogP1.55
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide (CID 46981067) is 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide is O=C(CN1CCN(C2CCCC2)C(=O)C1)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide?
The InChIKey is ZEZZXZIJDOJGBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4O3/c26-20(15-23-9-10-25(21(27)16-23)17-5-1-2-6-17)22-18-7-3-4-8-19(18)24-11-13-28-14-12-24/h3-4,7-8,17H,1-2,5-6,9-16H2,(H,22,26).
What are the key properties of 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide?
2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide has a molecular weight of 386.50 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopentyl-3-oxopiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 46981067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).