[1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine

C11H19F3N2 — CID 105269859

IUPAC[1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine
SMILESNNC(CCC(F)(F)F)CC1=CCCCC1
InChIInChI=1S/C11H19F3N2/c12-11(13,14)7-6-10(16-15)8-9-4-2-1-3-5-9/h4,10,16H,1-3,5-8,15H2
InChIKeyVFSHUPOGSRRYNB-UHFFFAOYSA-N
MW236.28 g/mol
LogP3.05
Rot. Bonds5

About [1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine

[1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine (PubChem CID 105269859) has the molecular formula C11H19F3N2 and a molecular weight of 236.28 g/mol. Its IUPAC name is [1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine
PubChem CID105269859
Molecular FormulaC11H19F3N2
Molecular Weight236.28 g/mol
Exact Mass236.15
IUPAC Name[1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine
SMILESNNC(CCC(F)(F)F)CC1=CCCCC1
InChIInChI=1S/C11H19F3N2/c12-11(13,14)7-6-10(16-15)8-9-4-2-1-3-5-9/h4,10,16H,1-3,5-8,15H2
InChIKeyVFSHUPOGSRRYNB-UHFFFAOYSA-N
XLogP3.05
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 53.05
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

N-methylmethanamine;[3-(trifluoromethyl)cyclohex-3-en-1-yl]hydrazine
CID 142330392
[(4Z)-6,6-difluorocyclooct-4-en-1-yl]hydrazine
CID 156051063
4-(4,4,4-Trifluorobutyl)cyclohex-3-en-1-amine
CID 83261254
1,1,1-Trifluoronon-8-en-4-ylhydrazine
CID 105248898
(1,1,1-Trifluoro-7-methyloct-7-en-4-yl)hydrazine
CID 105248965
(1,1,1-Trifluoro-6-methylideneoctan-4-yl)hydrazine
CID 105249074
(7,7,7-Trifluoro-2-methylhept-2-en-4-yl)hydrazine
CID 105249101
[1-(Cyclohexen-1-yl)-6,6,6-trifluorohexan-2-yl]hydrazine
CID 105269964
[3-Methyl-1-[3-(trifluoromethyl)cyclohexyl]but-2-enyl]hydrazine
CID 105319867
[1-(4,4-Difluorocyclohexyl)-3-methylbut-2-enyl]hydrazine
CID 105319872
[3-Methyl-1-[4-(trifluoromethyl)cyclohexyl]but-2-enyl]hydrazine
CID 105319898
[3-Methyl-1-[2-(trifluoromethyl)cyclohexyl]but-2-enyl]hydrazine
CID 105319944

Frequently Asked Questions

What is the IUPAC name of [1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine?
The IUPAC name of [1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine (CID 105269859) is [1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine.
What is the SMILES notation for [1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine?
The canonical SMILES for [1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine is NNC(CCC(F)(F)F)CC1=CCCCC1.
What is the InChIKey of [1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine?
The InChIKey is VFSHUPOGSRRYNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2/c12-11(13,14)7-6-10(16-15)8-9-4-2-1-3-5-9/h4,10,16H,1-3,5-8,15H2.
What are the key properties of [1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine?
[1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine has a molecular weight of 236.28 g/mol, XLogP of 3.05, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine is sourced from PubChem (CID 105269859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).