[1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine

C16H28N2O3 — CID 105273908

IUPAC[1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine
SMILESCCOC(C(NN)c1ccc(OC)cc1OC)C(C)(C)C
InChIInChI=1S/C16H28N2O3/c1-7-21-15(16(2,3)4)14(18-17)12-9-8-11(19-5)10-13(12)20-6/h8-10,14-15,18H,7,17H2,1-6H3
InChIKeyIBYCJNJCVFRIMN-UHFFFAOYSA-N
MW296.41 g/mol
LogP2.66
Rot. Bonds7

About [1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine

[1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine (PubChem CID 105273908) has the molecular formula C16H28N2O3 and a molecular weight of 296.41 g/mol. Its IUPAC name is [1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine
PubChem CID105273908
Molecular FormulaC16H28N2O3
Molecular Weight296.41 g/mol
Exact Mass296.21
IUPAC Name[1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine
SMILESCCOC(C(NN)c1ccc(OC)cc1OC)C(C)(C)C
InChIInChI=1S/C16H28N2O3/c1-7-21-15(16(2,3)4)14(18-17)12-9-8-11(19-5)10-13(12)20-6/h8-10,14-15,18H,7,17H2,1-6H3
InChIKeyIBYCJNJCVFRIMN-UHFFFAOYSA-N
XLogP2.66
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutan-1-ol
CID 116713378
[1-(2,4-dimethoxyphenyl)-2-ethoxypentyl]hydrazine
CID 105271557
[1-(2,4-dimethoxyphenyl)-2,3-dimethylbutyl]hydrazine
CID 105304556
[1-(2,4-dimethoxyphenyl)-2,2-dimethylpropyl]hydrazine
CID 105203197
2-ethoxy-1-(2-fluoro-4-methoxyphenyl)-N,3,3-trimethylbutan-1-amine
CID 103395874
[2-ethoxy-1-(4-ethoxyphenyl)-3,3-dimethylbutyl]hydrazine
CID 105273710
[2-ethoxy-3,3-dimethyl-1-(2-methylphenyl)butyl]hydrazine
CID 105273631
1-(2,4-dimethoxyphenyl)-2-methoxy-3,3-dimethylbutan-1-amine
CID 116724315
1-(2,4-dimethoxyphenyl)-2-ethoxy-N-ethylbutan-1-amine
CID 116717031
1-(2,4-dimethoxyphenyl)-2-methoxy-3,3-dimethylbutan-1-ol
CID 116713087
2-ethoxy-1-(2-methoxy-5-methylphenyl)-N,3,3-trimethylbutan-1-amine
CID 116725452
[1-(2,5-dimethoxyphenyl)-2-methylpropyl]hydrazine
CID 105199640

Frequently Asked Questions

What is the IUPAC name of [1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine?
The IUPAC name of [1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine (CID 105273908) is [1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine.
What is the SMILES notation for [1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine?
The canonical SMILES for [1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine is CCOC(C(NN)c1ccc(OC)cc1OC)C(C)(C)C.
What is the InChIKey of [1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine?
The InChIKey is IBYCJNJCVFRIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O3/c1-7-21-15(16(2,3)4)14(18-17)12-9-8-11(19-5)10-13(12)20-6/h8-10,14-15,18H,7,17H2,1-6H3.
What are the key properties of [1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine?
[1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine has a molecular weight of 296.41 g/mol, XLogP of 2.66, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,4-dimethoxyphenyl)-2-ethoxy-3,3-dimethylbutyl]hydrazine is sourced from PubChem (CID 105273908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).