cyclohexyl(trimethyl)azanium;fluoroform

C11H22F6N+ — CID 158064313

IUPACcyclohexyl(trimethyl)azanium;fluoroform
SMILESC[N+](C)(C)C1CCCCC1.FC(F)F.FC(F)F
InChIInChI=1S/C9H20N.2CHF3/c1-10(2,3)9-7-5-4-6-8-9;2*2-1(3)4/h9H,4-8H2,1-3H3;2*1H/q+1;;
InChIKeyFLAOEQPKHSUTCM-UHFFFAOYSA-N
MW282.29 g/mol
LogP4.38
Rot. Bonds1

About cyclohexyl(trimethyl)azanium;fluoroform

cyclohexyl(trimethyl)azanium;fluoroform (PubChem CID 158064313) has the molecular formula C11H22F6N+ and a molecular weight of 282.29 g/mol. Its IUPAC name is cyclohexyl(trimethyl)azanium;fluoroform.

Molecular Properties

Compound Namecyclohexyl(trimethyl)azanium;fluoroform
PubChem CID158064313
Molecular FormulaC11H22F6N+
Molecular Weight282.29 g/mol
Exact Mass282.17
IUPAC Namecyclohexyl(trimethyl)azanium;fluoroform
SMILESC[N+](C)(C)C1CCCCC1.FC(F)F.FC(F)F
InChIInChI=1S/C9H20N.2CHF3/c1-10(2,3)9-7-5-4-6-8-9;2*2-1(3)4/h9H,4-8H2,1-3H3;2*1H/q+1;;
InChIKeyFLAOEQPKHSUTCM-UHFFFAOYSA-N
XLogP4.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.29
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Analyze cyclohexyl(trimethyl)azanium;fluoroform 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

cyclodecyl(trimethyl)azanium chloride
CID 134900881
cyclododecyl(trimethyl)azanium bromide
CID 175020477
cyclohexyl(trimethyl)azanium tetrafluoroborate
CID 139649769
tris(cyclododecyl(trimethyl)azanium);phosphate
CID 175529097
cyclohexyl-(difluoromethyl)-dimethylazanium iodide
CID 24750838
cyclohexyl(trimethyl)azanium nitrate
CID 15953491
cyclohexyl-dimethyl-sulfanylazanium
CID 143973159
tetra(cyclodecyl)azanium bromide
CID 139704805
cyclohexyl-ethyl-dimethylazanium;hydroxide;hydrate
CID 171472457
cyclohexyl-hydroxy-dimethylazanium perchlorate
CID 16726157
cyclopentyl-diethyl-methylazanium
CID 153152970
dicyclohexylmethyl(trimethyl)azanium
CID 140500252

Frequently Asked Questions

What is the IUPAC name of cyclohexyl(trimethyl)azanium;fluoroform?
The IUPAC name of cyclohexyl(trimethyl)azanium;fluoroform (CID 158064313) is cyclohexyl(trimethyl)azanium;fluoroform.
What is the SMILES notation for cyclohexyl(trimethyl)azanium;fluoroform?
The canonical SMILES for cyclohexyl(trimethyl)azanium;fluoroform is C[N+](C)(C)C1CCCCC1.FC(F)F.FC(F)F.
What is the InChIKey of cyclohexyl(trimethyl)azanium;fluoroform?
The InChIKey is FLAOEQPKHSUTCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N.2CHF3/c1-10(2,3)9-7-5-4-6-8-9;2*2-1(3)4/h9H,4-8H2,1-3H3;2*1H/q+1;;.
What are the key properties of cyclohexyl(trimethyl)azanium;fluoroform?
cyclohexyl(trimethyl)azanium;fluoroform has a molecular weight of 282.29 g/mol, XLogP of 4.38, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl(trimethyl)azanium;fluoroform is sourced from PubChem (CID 158064313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).