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

C13H15F3N2O2 — CID 103217797

IUPAC[1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
SMILESCc1ccc2oc(C(COCC(F)(F)F)NN)cc2c1
InChIInChI=1S/C13H15F3N2O2/c1-8-2-3-11-9(4-8)5-12(20-11)10(18-17)6-19-7-13(14,15)16/h2-5,10,18H,6-7,17H2,1H3
InChIKeyQHHYBKARZINTIF-UHFFFAOYSA-N
MW288.27 g/mol
LogP2.82
Rot. Bonds5

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

[1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine (PubChem CID 103217797) has the molecular formula C13H15F3N2O2 and a molecular weight of 288.27 g/mol. Its IUPAC name is [1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
PubChem CID103217797
Molecular FormulaC13H15F3N2O2
Molecular Weight288.27 g/mol
Exact Mass288.11
IUPAC Name[1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
SMILESCc1ccc2oc(C(COCC(F)(F)F)NN)cc2c1
InChIInChI=1S/C13H15F3N2O2/c1-8-2-3-11-9(4-8)5-12(20-11)10(18-17)6-19-7-13(14,15)16/h2-5,10,18H,6-7,17H2,1H3
InChIKeyQHHYBKARZINTIF-UHFFFAOYSA-N
XLogP2.82
TPSA60.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.27
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[2-ethoxy-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine
CID 105235203
[3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine
CID 105338315
[1-(1-benzofuran-2-yl)-2-(2,2,3,3-tetrafluoropropoxy)ethyl]hydrazine
CID 103477764
[2-ethoxy-1-(5-fluoro-1-benzofuran-2-yl)ethyl]hydrazine
CID 105235462
1-(5-methyl-1-benzofuran-2-yl)but-3-enylhydrazine
CID 105269594
1-(5-methyl-1-benzofuran-2-yl)propan-1-amine
CID 65440376
[1-(3,4-dimethylphenyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 103217414
5,5,5-trifluoro-1-(5-methyl-1-benzofuran-2-yl)pentan-1-ol
CID 105120593
[1-(5-methyl-1-benzofuran-2-yl)-2-(2-methylphenyl)ethyl]hydrazine
CID 105208272
1-(5-chloro-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethanol
CID 103217135
[1-(2-fluoro-4,6-dimethylphenyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 106884466
1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine
CID 105311268

Frequently Asked Questions

What is the IUPAC name of [1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The IUPAC name of [1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine (CID 103217797) is [1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine.
What is the SMILES notation for [1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The canonical SMILES for [1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine is Cc1ccc2oc(C(COCC(F)(F)F)NN)cc2c1.
What is the InChIKey of [1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The InChIKey is QHHYBKARZINTIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F3N2O2/c1-8-2-3-11-9(4-8)5-12(20-11)10(18-17)6-19-7-13(14,15)16/h2-5,10,18H,6-7,17H2,1H3.
What are the key properties of [1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
[1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine has a molecular weight of 288.27 g/mol, XLogP of 2.82, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine is sourced from PubChem (CID 103217797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).