1,1,1-trifluorohept-6-en-2-ylhydrazine

C7H13F3N2 — CID 105215585

IUPAC1,1,1-trifluorohept-6-en-2-ylhydrazine
SMILESC=CCCCC(NN)C(F)(F)F
InChIInChI=1S/C7H13F3N2/c1-2-3-4-5-6(12-11)7(8,9)10/h2,6,12H,1,3-5,11H2
InChIKeyAFAHUBNQIHDNBR-UHFFFAOYSA-N
MW182.19 g/mol
LogP1.74
Rot. Bonds5

About 1,1,1-trifluorohept-6-en-2-ylhydrazine

1,1,1-trifluorohept-6-en-2-ylhydrazine (PubChem CID 105215585) has the molecular formula C7H13F3N2 and a molecular weight of 182.19 g/mol. Its IUPAC name is 1,1,1-trifluorohept-6-en-2-ylhydrazine.

Molecular Properties

Compound Name1,1,1-trifluorohept-6-en-2-ylhydrazine
PubChem CID105215585
Molecular FormulaC7H13F3N2
Molecular Weight182.19 g/mol
Exact Mass182.10
IUPAC Name1,1,1-trifluorohept-6-en-2-ylhydrazine
SMILESC=CCCCC(NN)C(F)(F)F
InChIInChI=1S/C7H13F3N2/c1-2-3-4-5-6(12-11)7(8,9)10/h2,6,12H,1,3-5,11H2
InChIKeyAFAHUBNQIHDNBR-UHFFFAOYSA-N
XLogP1.74
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.19
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1,1,1-trifluorohept-6-en-2-ylhydrazine 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
[(4Z)-6,6-difluorocyclooct-4-en-1-yl]hydrazine
CID 156051063
[1,1,1-Trifluoro-2-(trifluoromethyl)hept-6-en-3-yl]hydrazine
CID 103312821
1,1,1-Trifluorooct-7-en-3-ylhydrazine
CID 105205883
(1,1,1-Trifluoro-6-methylhept-6-en-3-yl)hydrazine
CID 105205974
1,1,1-Trifluorohept-6-en-3-ylhydrazine
CID 105205989
1,1,1-Trifluorohex-5-en-3-ylhydrazine
CID 105206053
(1,1,1-Trifluoro-5-methylhex-5-en-3-yl)hydrazine
CID 105206128
(1,1,1-Trifluoro-5-methylideneheptan-3-yl)hydrazine
CID 105206136
(1,1,1-Trifluoro-5-methylhex-5-en-2-yl)hydrazine
CID 105215672
1,1,1-Trifluorohex-5-en-2-ylhydrazine
CID 105215684
1,1,1-Trifluoropent-4-en-2-ylhydrazine
CID 105215743

Frequently Asked Questions

What is the IUPAC name of 1,1,1-trifluorohept-6-en-2-ylhydrazine?
The IUPAC name of 1,1,1-trifluorohept-6-en-2-ylhydrazine (CID 105215585) is 1,1,1-trifluorohept-6-en-2-ylhydrazine.
What is the SMILES notation for 1,1,1-trifluorohept-6-en-2-ylhydrazine?
The canonical SMILES for 1,1,1-trifluorohept-6-en-2-ylhydrazine is C=CCCCC(NN)C(F)(F)F.
What is the InChIKey of 1,1,1-trifluorohept-6-en-2-ylhydrazine?
The InChIKey is AFAHUBNQIHDNBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F3N2/c1-2-3-4-5-6(12-11)7(8,9)10/h2,6,12H,1,3-5,11H2.
What are the key properties of 1,1,1-trifluorohept-6-en-2-ylhydrazine?
1,1,1-trifluorohept-6-en-2-ylhydrazine has a molecular weight of 182.19 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1-trifluorohept-6-en-2-ylhydrazine is sourced from PubChem (CID 105215585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).