1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione

C24H45N5O2 — CID 19373533

IUPAC1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione
SMILESCC1(C)CC(NCCN2CCN(C3CC(C)(C)NC(C)(C)C3)C(=O)C2=O)CC(C)(C)N1
InChIInChI=1S/C24H45N5O2/c1-21(2)13-17(14-22(3,4)26-21)25-9-10-28-11-12-29(20(31)19(28)30)18-15-23(5,6)27-24(7,8)16-18/h17-18,25-27H,9-16H2,1-8H3
InChIKeyNERSPDLKUJZKCI-UHFFFAOYSA-N
MW435.66 g/mol
LogP1.87
Rot. Bonds5

About 1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione

1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione (PubChem CID 19373533) has the molecular formula C24H45N5O2 and a molecular weight of 435.66 g/mol. Its IUPAC name is 1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione.

Molecular Properties

Compound Name1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione
PubChem CID19373533
Molecular FormulaC24H45N5O2
Molecular Weight435.66 g/mol
Exact Mass435.36
IUPAC Name1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione
SMILESCC1(C)CC(NCCN2CCN(C3CC(C)(C)NC(C)(C)C3)C(=O)C2=O)CC(C)(C)N1
InChIInChI=1S/C24H45N5O2/c1-21(2)13-17(14-22(3,4)26-21)25-9-10-28-11-12-29(20(31)19(28)30)18-15-23(5,6)27-24(7,8)16-18/h17-18,25-27H,9-16H2,1-8H3
InChIKeyNERSPDLKUJZKCI-UHFFFAOYSA-N
XLogP1.87
TPSA76.71 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.66
LogP ≤ 51.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(cyclopropylamino)ethyl]-4-methylpiperazine-2,3-dione
CID 62927219
1-[2-(cyclopropylamino)ethyl]-4-propan-2-ylpiperazine-2,3-dione
CID 113463133
2,2,6,6-tetramethyl-N-(3-methylbutyl)piperidin-4-amine
CID 28674820
N-(3,3-dimethylbutyl)-2,2,6,6-tetramethylpiperidin-4-amine
CID 55023892
CID 22982947
CID 22982947
N-dodecyl-2,2,6,6-tetramethylpiperidin-4-amine;2,2,6,6-tetramethylpiperidin-4-one
CID 159184325
3-N-methyl-1-N-(2,2,6,6-tetramethylpiperidin-4-yl)butane-1,3-diamine
CID 154081474
N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine;N-butyl-2,2,6,6-tetramethylpiperidin-4-amine
CID 68740612
N-methyl-N'-(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine
CID 59934523
3-[4-[3,4-dioxo-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]cyclobuten-1-yl]piperazin-1-yl]propanenitrile
CID 53371304
N-hexyl-2,2,6,6-tetramethyl-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-4-amine
CID 173322725
1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-2,6-dione
CID 11615794

Frequently Asked Questions

What is the IUPAC name of 1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione?
The IUPAC name of 1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione (CID 19373533) is 1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione.
What is the SMILES notation for 1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione?
The canonical SMILES for 1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione is CC1(C)CC(NCCN2CCN(C3CC(C)(C)NC(C)(C)C3)C(=O)C2=O)CC(C)(C)N1.
What is the InChIKey of 1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione?
The InChIKey is NERSPDLKUJZKCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H45N5O2/c1-21(2)13-17(14-22(3,4)26-21)25-9-10-28-11-12-29(20(31)19(28)30)18-15-23(5,6)27-24(7,8)16-18/h17-18,25-27H,9-16H2,1-8H3.
What are the key properties of 1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione?
1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione has a molecular weight of 435.66 g/mol, XLogP of 1.87, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2,6,6-tetramethylpiperidin-4-yl)-4-[2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]piperazine-2,3-dione is sourced from PubChem (CID 19373533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).