[4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine

C13H23F3N2 — CID 105336006

IUPAC[4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine
SMILESC=C(C)CCC(NN)C1CCCCC1C(F)(F)F
InChIInChI=1S/C13H23F3N2/c1-9(2)7-8-12(18-17)10-5-3-4-6-11(10)13(14,15)16/h10-12,18H,1,3-8,17H2,2H3
InChIKeyFMPDMQFHJGPVIJ-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.54
Rot. Bonds5

About [4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine

[4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine (PubChem CID 105336006) has the molecular formula C13H23F3N2 and a molecular weight of 264.33 g/mol. Its IUPAC name is [4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine.

Molecular Properties

Compound Name[4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine
PubChem CID105336006
Molecular FormulaC13H23F3N2
Molecular Weight264.33 g/mol
Exact Mass264.18
IUPAC Name[4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine
SMILESC=C(C)CCC(NN)C1CCCCC1C(F)(F)F
InChIInChI=1S/C13H23F3N2/c1-9(2)7-8-12(18-17)10-5-3-4-6-11(10)13(14,15)16/h10-12,18H,1,3-8,17H2,2H3
InChIKeyFMPDMQFHJGPVIJ-UHFFFAOYSA-N
XLogP3.54
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.54
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'}

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Related Compounds

1-[2-(trifluoromethyl)cyclohexyl]hex-5-enylhydrazine
CID 105311422
N-methyl-1-[2-(trifluoromethyl)cyclohexyl]but-3-en-1-amine
CID 105108665
[3-(2-methylpyrazol-3-yl)-1-[2-(trifluoromethyl)cyclohexyl]propyl]hydrazine
CID 103026021
2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
CID 105139095
[2-(4-fluorophenyl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine
CID 105283838
[2-methyl-1-[2-(trifluoromethyl)cyclohexyl]propyl]hydrazine
CID 105281791
[1-(7-bicyclo[4.1.0]heptanyl)-3-methylbut-3-enyl]hydrazine
CID 105319620
[1-(3-ethylcyclohexyl)-4-methylpent-4-enyl]hydrazine
CID 105232886
1-(7-bicyclo[4.1.0]heptanyl)-N-ethyl-4-methylpent-4-en-1-amine
CID 105039219
N-ethyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-en-1-amine
CID 105153388
(1-cyclobutyl-5-methylhex-5-en-2-yl)hydrazine
CID 103170793
3-methylidene-1-[2-(trifluoromethyl)cyclohexyl]pentan-1-amine
CID 105164028

Frequently Asked Questions

What is the IUPAC name of [4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine?
The IUPAC name of [4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine (CID 105336006) is [4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine.
What is the SMILES notation for [4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine?
The canonical SMILES for [4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine is C=C(C)CCC(NN)C1CCCCC1C(F)(F)F.
What is the InChIKey of [4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine?
The InChIKey is FMPDMQFHJGPVIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23F3N2/c1-9(2)7-8-12(18-17)10-5-3-4-6-11(10)13(14,15)16/h10-12,18H,1,3-8,17H2,2H3.
What are the key properties of [4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine?
[4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine has a molecular weight of 264.33 g/mol, XLogP of 3.54, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pent-4-enyl]hydrazine is sourced from PubChem (CID 105336006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).