N,N',3,3,6,6-hexamethyloctanediamide

C14H28N2O2 — CID 54555561

IUPACN,N',3,3,6,6-hexamethyloctanediamide
SMILESCNC(=O)CC(C)(C)CCC(C)(C)CC(=O)NC
InChIInChI=1S/C14H28N2O2/c1-13(2,9-11(17)15-5)7-8-14(3,4)10-12(18)16-6/h7-10H2,1-6H3,(H,15,17)(H,16,18)
InChIKeyZMXWDIOBRHHQHR-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.09
Rot. Bonds7

About N,N',3,3,6,6-hexamethyloctanediamide

N,N',3,3,6,6-hexamethyloctanediamide (PubChem CID 54555561) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N,N',3,3,6,6-hexamethyloctanediamide.

Molecular Properties

Compound NameN,N',3,3,6,6-hexamethyloctanediamide
PubChem CID54555561
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN,N',3,3,6,6-hexamethyloctanediamide
SMILESCNC(=O)CC(C)(C)CCC(C)(C)CC(=O)NC
InChIInChI=1S/C14H28N2O2/c1-13(2,9-11(17)15-5)7-8-14(3,4)10-12(18)16-6/h7-10H2,1-6H3,(H,15,17)(H,16,18)
InChIKeyZMXWDIOBRHHQHR-UHFFFAOYSA-N
XLogP2.09
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N',3,3,6,6-hexamethyloctanediamide?
The IUPAC name of N,N',3,3,6,6-hexamethyloctanediamide (CID 54555561) is N,N',3,3,6,6-hexamethyloctanediamide.
What is the SMILES notation for N,N',3,3,6,6-hexamethyloctanediamide?
The canonical SMILES for N,N',3,3,6,6-hexamethyloctanediamide is CNC(=O)CC(C)(C)CCC(C)(C)CC(=O)NC.
What is the InChIKey of N,N',3,3,6,6-hexamethyloctanediamide?
The InChIKey is ZMXWDIOBRHHQHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-13(2,9-11(17)15-5)7-8-14(3,4)10-12(18)16-6/h7-10H2,1-6H3,(H,15,17)(H,16,18).
What are the key properties of N,N',3,3,6,6-hexamethyloctanediamide?
N,N',3,3,6,6-hexamethyloctanediamide has a molecular weight of 256.39 g/mol, XLogP of 2.09, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N',3,3,6,6-hexamethyloctanediamide is sourced from PubChem (CID 54555561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).