(3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine

C13H30N2O2 — CID 103027085

IUPAC(3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine
SMILESCCOC(C(C)C)C(CCC(C)(C)OC)NN
InChIInChI=1S/C13H30N2O2/c1-7-17-12(10(2)3)11(15-14)8-9-13(4,5)16-6/h10-12,15H,7-9,14H2,1-6H3
InChIKeyCONHUQKEPLXBAD-UHFFFAOYSA-N
MW246.39 g/mol
LogP2.08
Rot. Bonds9

About (3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine

(3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine (PubChem CID 103027085) has the molecular formula C13H30N2O2 and a molecular weight of 246.39 g/mol. Its IUPAC name is (3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine.

Molecular Properties

Compound Name(3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine
PubChem CID103027085
Molecular FormulaC13H30N2O2
Molecular Weight246.39 g/mol
Exact Mass246.23
IUPAC Name(3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine
SMILESCCOC(C(C)C)C(CCC(C)(C)OC)NN
InChIInChI=1S/C13H30N2O2/c1-7-17-12(10(2)3)11(15-14)8-9-13(4,5)16-6/h10-12,15H,7-9,14H2,1-6H3
InChIKeyCONHUQKEPLXBAD-UHFFFAOYSA-N
XLogP2.08
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[3-Methoxy-3-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)butyl]hydrazine
CID 103025520
(1-Ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine
CID 103026298
[4-Methoxy-4-methyl-1-(3-methyloxolan-2-yl)pentyl]hydrazine
CID 103026313
[4-Methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine
CID 103026315
(1,5-Dimethoxy-5-methylhexan-2-yl)hydrazine
CID 103026325
[4-Methoxy-4-methyl-1-(2-methyloxolan-3-yl)pentyl]hydrazine
CID 103026590
(1,7-Dimethoxy-2,7-dimethyloctan-4-yl)hydrazine
CID 103026594
(5-Methoxy-5-methyl-1-propoxyhexan-2-yl)hydrazine
CID 103026700
[4-Methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine
CID 103026972
(2,7-Dimethoxy-7-methyloctan-4-yl)hydrazine
CID 103027050
[4-Methoxy-1-(1-methoxycyclopentyl)-4-methylpentyl]hydrazine
CID 103027058
(3-Ethoxy-7-methoxy-2,2,7-trimethyloctan-4-yl)hydrazine
CID 103027096

Frequently Asked Questions

What is the IUPAC name of (3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine?
The IUPAC name of (3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine (CID 103027085) is (3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine.
What is the SMILES notation for (3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine?
The canonical SMILES for (3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine is CCOC(C(C)C)C(CCC(C)(C)OC)NN.
What is the InChIKey of (3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine?
The InChIKey is CONHUQKEPLXBAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O2/c1-7-17-12(10(2)3)11(15-14)8-9-13(4,5)16-6/h10-12,15H,7-9,14H2,1-6H3.
What are the key properties of (3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine?
(3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine has a molecular weight of 246.39 g/mol, XLogP of 2.08, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine is sourced from PubChem (CID 103027085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).