6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide

C15H30N2O2 — CID 106712483

IUPAC6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCCOC1CC(C)OC(C)C1
InChIInChI=1S/C15H30N2O2/c1-11-9-13(10-12(2)19-11)18-8-6-5-7-15(3,4)14(16)17/h11-13H,5-10H2,1-4H3,(H3,16,17)
InChIKeyUNKZVLTZMASUOU-UHFFFAOYSA-N
MW270.42 g/mol
LogP3.09
Rot. Bonds7

About 6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide

6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide (PubChem CID 106712483) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide.

Molecular Properties

Compound Name6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide
PubChem CID106712483
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCCOC1CC(C)OC(C)C1
InChIInChI=1S/C15H30N2O2/c1-11-9-13(10-12(2)19-11)18-8-6-5-7-15(3,4)14(16)17/h11-13H,5-10H2,1-4H3,(H3,16,17)
InChIKeyUNKZVLTZMASUOU-UHFFFAOYSA-N
XLogP3.09
TPSA68.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide?
The IUPAC name of 6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide (CID 106712483) is 6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide.
What is the SMILES notation for 6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide?
The canonical SMILES for 6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide is [H]/N=C(\N)C(C)(C)CCCCOC1CC(C)OC(C)C1.
What is the InChIKey of 6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide?
The InChIKey is UNKZVLTZMASUOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-11-9-13(10-12(2)19-11)18-8-6-5-7-15(3,4)14(16)17/h11-13H,5-10H2,1-4H3,(H3,16,17).
What are the key properties of 6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide?
6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide has a molecular weight of 270.42 g/mol, XLogP of 3.09, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-dimethyloxan-4-yl)oxy-2,2-dimethylhexanimidamide is sourced from PubChem (CID 106712483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).