[4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine

C8H15F3N2O — CID 103217613

IUPAC[4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine
SMILESC=C(C)CC(COCC(F)(F)F)NN
InChIInChI=1S/C8H15F3N2O/c1-6(2)3-7(13-12)4-14-5-8(9,10)11/h7,13H,1,3-5,12H2,2H3
InChIKeyFWOFDQNSOUIHCE-UHFFFAOYSA-N
MW212.21 g/mol
LogP1.36
Rot. Bonds6

About [4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine

[4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine (PubChem CID 103217613) has the molecular formula C8H15F3N2O and a molecular weight of 212.21 g/mol. Its IUPAC name is [4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine.

Molecular Properties

Compound Name[4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine
PubChem CID103217613
Molecular FormulaC8H15F3N2O
Molecular Weight212.21 g/mol
Exact Mass212.11
IUPAC Name[4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine
SMILESC=C(C)CC(COCC(F)(F)F)NN
InChIInChI=1S/C8H15F3N2O/c1-6(2)3-7(13-12)4-14-5-8(9,10)11/h7,13H,1,3-5,12H2,2H3
InChIKeyFWOFDQNSOUIHCE-UHFFFAOYSA-N
XLogP1.36
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[6-Methyl-1-(2,2,2-trifluoroethoxy)hept-6-en-3-yl]hydrazine
CID 103151449
[5-Methylidene-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151481
[2-Methyl-5-(2,2,2-trifluoroethoxy)pent-1-en-3-yl]hydrazine
CID 103151550
[5-Methyl-1-(2,2,2-trifluoroethoxy)hex-5-en-3-yl]hydrazine
CID 103151729
[1-(2,2-Difluoroethoxy)-6-methylhept-6-en-3-yl]hydrazine
CID 103151769
[1-(2,2-Difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine
CID 103151798
[5-(2,2-Difluoroethoxy)-2-methylpent-1-en-3-yl]hydrazine
CID 103151872
[1-(2,2-Difluoroethoxy)-5-methylhex-5-en-3-yl]hydrazine
CID 103152071
4-Methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-amine
CID 103215714
1-(2,2,2-Trifluoroethoxy)hept-6-en-2-ylhydrazine
CID 103217531
1-(2,2,2-Trifluoroethoxy)hex-5-en-2-ylhydrazine
CID 103217533
[3-Methyl-1-(2,2,2-trifluoroethoxy)but-3-en-2-yl]hydrazine
CID 103217617

Frequently Asked Questions

What is the IUPAC name of [4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine?
The IUPAC name of [4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine (CID 103217613) is [4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine.
What is the SMILES notation for [4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine?
The canonical SMILES for [4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine is C=C(C)CC(COCC(F)(F)F)NN.
What is the InChIKey of [4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine?
The InChIKey is FWOFDQNSOUIHCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2O/c1-6(2)3-7(13-12)4-14-5-8(9,10)11/h7,13H,1,3-5,12H2,2H3.
What are the key properties of [4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine?
[4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine has a molecular weight of 212.21 g/mol, XLogP of 1.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-yl]hydrazine is sourced from PubChem (CID 103217613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).