2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide

C20H38N4O3 — CID 24719241

IUPAC2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide
SMILESCCN(CC)CCNC(=O)C(C1CCCC1)N1CCN(C(=O)COC)CC1
InChIInChI=1S/C20H38N4O3/c1-4-22(5-2)11-10-21-20(26)19(17-8-6-7-9-17)24-14-12-23(13-15-24)18(25)16-27-3/h17,19H,4-16H2,1-3H3,(H,21,26)
InChIKeyWPTKOVMYSXAYIK-UHFFFAOYSA-N
MW382.55 g/mol
LogP0.79
Rot. Bonds10

About 2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide

2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide (PubChem CID 24719241) has the molecular formula C20H38N4O3 and a molecular weight of 382.55 g/mol. Its IUPAC name is 2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide
PubChem CID24719241
Molecular FormulaC20H38N4O3
Molecular Weight382.55 g/mol
Exact Mass382.29
IUPAC Name2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide
SMILESCCN(CC)CCNC(=O)C(C1CCCC1)N1CCN(C(=O)COC)CC1
InChIInChI=1S/C20H38N4O3/c1-4-22(5-2)11-10-21-20(26)19(17-8-6-7-9-17)24-14-12-23(13-15-24)18(25)16-27-3/h17,19H,4-16H2,1-3H3,(H,21,26)
InChIKeyWPTKOVMYSXAYIK-UHFFFAOYSA-N
XLogP0.79
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.55
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide?
The IUPAC name of 2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide (CID 24719241) is 2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide.
What is the SMILES notation for 2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide?
The canonical SMILES for 2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide is CCN(CC)CCNC(=O)C(C1CCCC1)N1CCN(C(=O)COC)CC1.
What is the InChIKey of 2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide?
The InChIKey is WPTKOVMYSXAYIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38N4O3/c1-4-22(5-2)11-10-21-20(26)19(17-8-6-7-9-17)24-14-12-23(13-15-24)18(25)16-27-3/h17,19H,4-16H2,1-3H3,(H,21,26).
What are the key properties of 2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide?
2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide has a molecular weight of 382.55 g/mol, XLogP of 0.79, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[2-(diethylamino)ethyl]-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 24719241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).