[4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine

C15H26N2O — CID 105205098

IUPAC[4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine
SMILESCCC(CC)CC(Cc1ccccc1OC)NN
InChIInChI=1S/C15H26N2O/c1-4-12(5-2)10-14(17-16)11-13-8-6-7-9-15(13)18-3/h6-9,12,14,17H,4-5,10-11,16H2,1-3H3
InChIKeyIXFSIQDGXIYCIH-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.90
Rot. Bonds8

About [4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine

[4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine (PubChem CID 105205098) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is [4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine.

Molecular Properties

Compound Name[4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine
PubChem CID105205098
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name[4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine
SMILESCCC(CC)CC(Cc1ccccc1OC)NN
InChIInChI=1S/C15H26N2O/c1-4-12(5-2)10-14(17-16)11-13-8-6-7-9-15(13)18-3/h6-9,12,14,17H,4-5,10-11,16H2,1-3H3
InChIKeyIXFSIQDGXIYCIH-UHFFFAOYSA-N
XLogP2.90
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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 [4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine?
The IUPAC name of [4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine (CID 105205098) is [4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine.
What is the SMILES notation for [4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine?
The canonical SMILES for [4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine is CCC(CC)CC(Cc1ccccc1OC)NN.
What is the InChIKey of [4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine?
The InChIKey is IXFSIQDGXIYCIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-4-12(5-2)10-14(17-16)11-13-8-6-7-9-15(13)18-3/h6-9,12,14,17H,4-5,10-11,16H2,1-3H3.
What are the key properties of [4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine?
[4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine has a molecular weight of 250.39 g/mol, XLogP of 2.90, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethyl-1-(2-methoxyphenyl)hexan-2-yl]hydrazine is sourced from PubChem (CID 105205098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).