1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione

C15H26N2O2 — CID 108504575

IUPAC1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione
SMILESCC1CCN(C(=O)C(=O)N2C(C)CCCC2C)CC1
InChIInChI=1S/C15H26N2O2/c1-11-7-9-16(10-8-11)14(18)15(19)17-12(2)5-4-6-13(17)3/h11-13H,4-10H2,1-3H3
InChIKeyGPSFKOSBZOTTIB-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.03
Rot. Bonds

About 1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione

1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione (PubChem CID 108504575) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione.

Molecular Properties

Compound Name1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione
PubChem CID108504575
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione
SMILESCC1CCN(C(=O)C(=O)N2C(C)CCCC2C)CC1
InChIInChI=1S/C15H26N2O2/c1-11-7-9-16(10-8-11)14(18)15(19)17-12(2)5-4-6-13(17)3/h11-13H,4-10H2,1-3H3
InChIKeyGPSFKOSBZOTTIB-UHFFFAOYSA-N
XLogP2.03
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione?
The IUPAC name of 1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione (CID 108504575) is 1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione.
What is the SMILES notation for 1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione?
The canonical SMILES for 1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione is CC1CCN(C(=O)C(=O)N2C(C)CCCC2C)CC1.
What is the InChIKey of 1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione?
The InChIKey is GPSFKOSBZOTTIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-11-7-9-16(10-8-11)14(18)15(19)17-12(2)5-4-6-13(17)3/h11-13H,4-10H2,1-3H3.
What are the key properties of 1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione?
1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione has a molecular weight of 266.38 g/mol, XLogP of 2.03, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylpiperidin-1-yl)-2-(4-methylpiperidin-1-yl)ethane-1,2-dione is sourced from PubChem (CID 108504575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).