(1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine

C11H26N2O2 — CID 103026539

IUPAC(1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine
SMILESCCOCCC(CCC(C)(C)OC)NN
InChIInChI=1S/C11H26N2O2/c1-5-15-9-7-10(13-12)6-8-11(2,3)14-4/h10,13H,5-9,12H2,1-4H3
InChIKeyHHTPMLYCXXTKNL-UHFFFAOYSA-N
MW218.34 g/mol
LogP1.45
Rot. Bonds9

About (1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine

(1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine (PubChem CID 103026539) has the molecular formula C11H26N2O2 and a molecular weight of 218.34 g/mol. Its IUPAC name is (1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine.

Molecular Properties

Compound Name(1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine
PubChem CID103026539
Molecular FormulaC11H26N2O2
Molecular Weight218.34 g/mol
Exact Mass218.20
IUPAC Name(1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine
SMILESCCOCCC(CCC(C)(C)OC)NN
InChIInChI=1S/C11H26N2O2/c1-5-15-9-7-10(13-12)6-8-11(2,3)14-4/h10,13H,5-9,12H2,1-4H3
InChIKeyHHTPMLYCXXTKNL-UHFFFAOYSA-N
XLogP1.45
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine?
The IUPAC name of (1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine (CID 103026539) is (1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine.
What is the SMILES notation for (1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine?
The canonical SMILES for (1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine is CCOCCC(CCC(C)(C)OC)NN.
What is the InChIKey of (1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine?
The InChIKey is HHTPMLYCXXTKNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O2/c1-5-15-9-7-10(13-12)6-8-11(2,3)14-4/h10,13H,5-9,12H2,1-4H3.
What are the key properties of (1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine?
(1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine has a molecular weight of 218.34 g/mol, XLogP of 1.45, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxy-6-methoxy-6-methylheptan-3-yl)hydrazine is sourced from PubChem (CID 103026539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).