A1CU6

1,1'-(piperidine-1,4-diyl)di(ethan-1-one)

Created:	2025-09-23
Last modified:	2026-02-18

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1 entries where A1CU6 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	27
Chiral Atom Count	0
Bond Count	27
Aromatic Bond Count	0

2D diagram of A1CU6

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Chemical Component Summary
Name	1,1'-(piperidine-1,4-diyl)di(ethan-1-one)
Systematic Name (OpenEye OEToolkits)	1-(1-ethanoylpiperidin-4-yl)ethanone
Formula	C₉ H₁₅ N O₂
Molecular Weight	169.221
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	14.52	O=C(C)N1CCC(CC1)C(C)=O
SMILES	CACTVS	3.385	CC(=O)C1CCN(CC1)C(C)=O
SMILES	OpenEye OEToolkits	3.1.0.0	CC(=O)C1CCN(CC1)C(=O)C
Canonical SMILES	CACTVS	3.385	CC(=O)C1CCN(CC1)C(C)=O
Canonical SMILES	OpenEye OEToolkits	3.1.0.0	CC(=O)C1CCN(CC1)C(=O)C
InChI	InChI	1.06	InChI=1S/C9H15NO2/c1-7(11)9-3-5-10(6-4-9)8(2)12/h9H,3-6H2,1-2H3
InChIKey	InChI	1.06	VFZXZEJGLKOTBW-UHFFFAOYSA-N

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.