[3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine

C14H20N2O2 — CID 105338315

IUPAC[3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine
SMILESCCOCCC(NN)c1cc2cc(C)ccc2o1
InChIInChI=1S/C14H20N2O2/c1-3-17-7-6-12(16-15)14-9-11-8-10(2)4-5-13(11)18-14/h4-5,8-9,12,16H,3,6-7,15H2,1-2H3
InChIKeyQDCXIRBPJUHSBG-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.67
Rot. Bonds6

About [3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine

[3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine (PubChem CID 105338315) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is [3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine.

Molecular Properties

Compound Name[3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine
PubChem CID105338315
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name[3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine
SMILESCCOCCC(NN)c1cc2cc(C)ccc2o1
InChIInChI=1S/C14H20N2O2/c1-3-17-7-6-12(16-15)14-9-11-8-10(2)4-5-13(11)18-14/h4-5,8-9,12,16H,3,6-7,15H2,1-2H3
InChIKeyQDCXIRBPJUHSBG-UHFFFAOYSA-N
XLogP2.67
TPSA60.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.67
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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Related Compounds

[2-ethoxy-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine
CID 105235203
1-(5-methyl-1-benzofuran-2-yl)but-3-enylhydrazine
CID 105269594
1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine
CID 105311268
1-(5-methyl-1-benzofuran-2-yl)propan-1-amine
CID 65440376
[1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 103217797
[2-ethoxy-1-(5-fluoro-1-benzofuran-2-yl)ethyl]hydrazine
CID 105235462
[2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine
CID 105324027
[1-(5-methyl-1-benzofuran-2-yl)-2-(2-methylphenyl)ethyl]hydrazine
CID 105208272
2,2-diethoxy-1-(5-methyl-1-benzofuran-2-yl)ethanamine
CID 114729833
1-(5-chloro-1-benzofuran-2-yl)butylhydrazine
CID 105202028
N-methyl-1-(5-methyl-1-benzofuran-2-yl)heptan-1-amine
CID 105045111
3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propan-1-one
CID 105131900

Frequently Asked Questions

What is the IUPAC name of [3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine?
The IUPAC name of [3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine (CID 105338315) is [3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine.
What is the SMILES notation for [3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine?
The canonical SMILES for [3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine is CCOCCC(NN)c1cc2cc(C)ccc2o1.
What is the InChIKey of [3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine?
The InChIKey is QDCXIRBPJUHSBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-3-17-7-6-12(16-15)14-9-11-8-10(2)4-5-13(11)18-14/h4-5,8-9,12,16H,3,6-7,15H2,1-2H3.
What are the key properties of [3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine?
[3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine has a molecular weight of 248.33 g/mol, XLogP of 2.67, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine is sourced from PubChem (CID 105338315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).