2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide

C13H26N2O2 — CID 130272292

IUPAC2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide
SMILESCNC(=O)CNC(=O)C(C)(C)CCC(C)(C)C
InChIInChI=1S/C13H26N2O2/c1-12(2,3)7-8-13(4,5)11(17)15-9-10(16)14-6/h7-9H2,1-6H3,(H,14,16)(H,15,17)
InChIKeyLPDJJKHDGUPBAE-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.70
Rot. Bonds5

About 2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide

2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide (PubChem CID 130272292) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide.

Molecular Properties

Compound Name2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide
PubChem CID130272292
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide
SMILESCNC(=O)CNC(=O)C(C)(C)CCC(C)(C)C
InChIInChI=1S/C13H26N2O2/c1-12(2,3)7-8-13(4,5)11(17)15-9-10(16)14-6/h7-9H2,1-6H3,(H,14,16)(H,15,17)
InChIKeyLPDJJKHDGUPBAE-UHFFFAOYSA-N
XLogP1.70
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide?
The IUPAC name of 2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide (CID 130272292) is 2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide.
What is the SMILES notation for 2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide?
The canonical SMILES for 2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide is CNC(=O)CNC(=O)C(C)(C)CCC(C)(C)C.
What is the InChIKey of 2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide?
The InChIKey is LPDJJKHDGUPBAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-12(2,3)7-8-13(4,5)11(17)15-9-10(16)14-6/h7-9H2,1-6H3,(H,14,16)(H,15,17).
What are the key properties of 2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide?
2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide has a molecular weight of 242.36 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,5-tetramethyl-N-[2-(methylamino)-2-oxoethyl]hexanamide is sourced from PubChem (CID 130272292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).