[5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine

C6H8F6N2 — CID 103312845

IUPAC[5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine
SMILESC=CC(NN)C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H8F6N2/c1-2-3(14-13)4(5(7,8)9)6(10,11)12/h2-4,14H,1,13H2
InChIKeyJNRAAUSSTFUWOA-UHFFFAOYSA-N
MW222.13 g/mol
LogP1.75
Rot. Bonds3

About [5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine

[5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine (PubChem CID 103312845) has the molecular formula C6H8F6N2 and a molecular weight of 222.13 g/mol. Its IUPAC name is [5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine.

Molecular Properties

Compound Name[5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine
PubChem CID103312845
Molecular FormulaC6H8F6N2
Molecular Weight222.13 g/mol
Exact Mass222.06
IUPAC Name[5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine
SMILESC=CC(NN)C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H8F6N2/c1-2-3(14-13)4(5(7,8)9)6(10,11)12/h2-4,14H,1,13H2
InChIKeyJNRAAUSSTFUWOA-UHFFFAOYSA-N
XLogP1.75
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.13
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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'}

Analyze [5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5,5,5-Trifluoropent-1-en-3-ylhydrazine
CID 105205886
[1,1,1-Trifluoro-2-(trifluoromethyl)hex-5-en-3-yl]hydrazine
CID 103312738
[1,1,1-Trifluoro-2-(trifluoromethyl)hept-6-en-3-yl]hydrazine
CID 103312821
[1,1,1-Trifluoro-5-methyl-2-(trifluoromethyl)hex-4-en-3-yl]hydrazine
CID 103312852
[5,5,5-Trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine
CID 103312853
1,1,1-Trifluorohex-5-en-3-ylhydrazine
CID 105206053
1,1,1-Trifluoropent-4-en-2-ylhydrazine
CID 105215743
6,6,6-Trifluorohex-1-en-3-ylhydrazine
CID 105248899
1,1-Difluoropent-4-en-2-ylhydrazine
CID 105265153
1,1,1-Trifluorobut-3-en-2-ylhydrazine
CID 121603792
1,1-Difluorobut-3-en-2-ylhydrazine
CID 121603982
4,4-Difluoropent-1-en-3-ylhydrazine
CID 130657320

Frequently Asked Questions

What is the IUPAC name of [5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine?
The IUPAC name of [5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine (CID 103312845) is [5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine.
What is the SMILES notation for [5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine?
The canonical SMILES for [5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine is C=CC(NN)C(C(F)(F)F)C(F)(F)F.
What is the InChIKey of [5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine?
The InChIKey is JNRAAUSSTFUWOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F6N2/c1-2-3(14-13)4(5(7,8)9)6(10,11)12/h2-4,14H,1,13H2.
What are the key properties of [5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine?
[5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine has a molecular weight of 222.13 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5,5,5-trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine is sourced from PubChem (CID 103312845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).