[2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine

C15H22N2O — CID 105324027

IUPAC[2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine
SMILESCCC(CC)C(NN)c1cc2cc(C)ccc2o1
InChIInChI=1S/C15H22N2O/c1-4-11(5-2)15(17-16)14-9-12-8-10(3)6-7-13(12)18-14/h6-9,11,15,17H,4-5,16H2,1-3H3
InChIKeyWCIPNNWYBBTNDR-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.68
Rot. Bonds5

About [2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine

[2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine (PubChem CID 105324027) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is [2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine.

Molecular Properties

Compound Name[2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine
PubChem CID105324027
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name[2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine
SMILESCCC(CC)C(NN)c1cc2cc(C)ccc2o1
InChIInChI=1S/C15H22N2O/c1-4-11(5-2)15(17-16)14-9-12-8-10(3)6-7-13(12)18-14/h6-9,11,15,17H,4-5,16H2,1-3H3
InChIKeyWCIPNNWYBBTNDR-UHFFFAOYSA-N
XLogP3.68
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.68
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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Related Compounds

N,2-diethyl-1-(5-methyl-1-benzofuran-2-yl)butan-1-amine
CID 105045193
1-(5-methyl-1-benzofuran-2-yl)propan-1-amine
CID 65440376
2-ethyl-N-methyl-1-(5-methyl-1-benzofuran-2-yl)hexan-1-amine
CID 105045206
N-methyl-1-(5-methyl-1-benzofuran-2-yl)-2-propylpentan-1-amine
CID 105045144
[2-ethoxy-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine
CID 105235203
1-(5-methyl-1-benzofuran-2-yl)-2-methylsulfanylethanamine
CID 114728409
1-(5-methyl-1-benzofuran-2-yl)but-3-enylhydrazine
CID 105269594
[1-(5-fluoro-1-benzofuran-2-yl)-2-propylpentyl]hydrazine
CID 105338630
[3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine
CID 105338315
2,2-diethoxy-1-(5-methyl-1-benzofuran-2-yl)ethanamine
CID 114729833
[(1-ethylcyclopentyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105338290
2,3-dimethyl-1-(5-methyl-1-benzofuran-2-yl)-N-propylbutan-1-amine
CID 105045138

Frequently Asked Questions

What is the IUPAC name of [2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine?
The IUPAC name of [2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine (CID 105324027) is [2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine.
What is the SMILES notation for [2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine?
The canonical SMILES for [2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine is CCC(CC)C(NN)c1cc2cc(C)ccc2o1.
What is the InChIKey of [2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine?
The InChIKey is WCIPNNWYBBTNDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-4-11(5-2)15(17-16)14-9-12-8-10(3)6-7-13(12)18-14/h6-9,11,15,17H,4-5,16H2,1-3H3.
What are the key properties of [2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine?
[2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine has a molecular weight of 246.35 g/mol, XLogP of 3.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine is sourced from PubChem (CID 105324027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).