[2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine

C12H17F3N2O2 — CID 105301408

IUPAC[2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine
SMILESCC(C)OCC(NN)c1ccccc1OC(F)(F)F
InChIInChI=1S/C12H17F3N2O2/c1-8(2)18-7-10(17-16)9-5-3-4-6-11(9)19-12(13,14)15/h3-6,8,10,17H,7,16H2,1-2H3
InChIKeyVQSVEUNRBKSLQD-UHFFFAOYSA-N
MW278.27 g/mol
LogP2.51
Rot. Bonds6

About [2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine

[2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine (PubChem CID 105301408) has the molecular formula C12H17F3N2O2 and a molecular weight of 278.27 g/mol. Its IUPAC name is [2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine.

Molecular Properties

Compound Name[2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine
PubChem CID105301408
Molecular FormulaC12H17F3N2O2
Molecular Weight278.27 g/mol
Exact Mass278.12
IUPAC Name[2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine
SMILESCC(C)OCC(NN)c1ccccc1OC(F)(F)F
InChIInChI=1S/C12H17F3N2O2/c1-8(2)18-7-10(17-16)9-5-3-4-6-11(9)19-12(13,14)15/h3-6,8,10,17H,7,16H2,1-2H3
InChIKeyVQSVEUNRBKSLQD-UHFFFAOYSA-N
XLogP2.51
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.27
LogP ≤ 52.51
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-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine
CID 105235372
[1-(2-fluorophenyl)-2-propan-2-yloxyethyl]hydrazine
CID 105216958
[2-butan-2-ylsulfanyl-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine
CID 105227240
[1-(2-fluoro-3-methylphenyl)-2-propan-2-yloxyethyl]hydrazine
CID 105323816
[1-(5-fluoro-2-methoxyphenyl)-2-propan-2-yloxyethyl]hydrazine
CID 105330779
[2-methyl-3-methylsulfanyl-1-[2-(trifluoromethoxy)phenyl]propyl]hydrazine
CID 114222154
[2-thiophen-3-yl-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine
CID 105301456
[1-(2-ethoxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethyl]hydrazine
CID 105304469
[2-cyclopentylsulfanyl-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine
CID 105227580
[1-(2-methoxyphenyl)-2-(2,2,3,3-tetrafluoropropoxy)ethyl]hydrazine
CID 103477696
1-(1-propoxyethyl)-2-(trifluoromethoxy)benzene
CID 67813246
1-butan-2-yl-2-(trifluoromethoxy)benzene;ethane
CID 142580959

Frequently Asked Questions

What is the IUPAC name of [2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine?
The IUPAC name of [2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine (CID 105301408) is [2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine.
What is the SMILES notation for [2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine?
The canonical SMILES for [2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine is CC(C)OCC(NN)c1ccccc1OC(F)(F)F.
What is the InChIKey of [2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine?
The InChIKey is VQSVEUNRBKSLQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17F3N2O2/c1-8(2)18-7-10(17-16)9-5-3-4-6-11(9)19-12(13,14)15/h3-6,8,10,17H,7,16H2,1-2H3.
What are the key properties of [2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine?
[2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine has a molecular weight of 278.27 g/mol, XLogP of 2.51, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-propan-2-yloxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine is sourced from PubChem (CID 105301408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).