ethyl-dimethyl-propylazanium hexafluorophosphate

C7H18F6NP — CID 140620148

IUPACethyl-dimethyl-propylazanium hexafluorophosphate
SMILESCCC[N+](C)(C)CC.F[P-](F)(F)(F)(F)F
InChIInChI=1S/C7H18N.F6P/c1-5-7-8(3,4)6-2;1-7(2,3,4,5)6/h5-7H2,1-4H3;/q+1;-1
InChIKeyNBANKOINPSAYNO-UHFFFAOYSA-N
MW261.19 g/mol
LogP4.88
Rot. Bonds3

About ethyl-dimethyl-propylazanium hexafluorophosphate

ethyl-dimethyl-propylazanium hexafluorophosphate (PubChem CID 140620148) has the molecular formula C7H18F6NP and a molecular weight of 261.19 g/mol. Its IUPAC name is ethyl-dimethyl-propylazanium hexafluorophosphate.

Molecular Properties

Compound Nameethyl-dimethyl-propylazanium hexafluorophosphate
PubChem CID140620148
Molecular FormulaC7H18F6NP
Molecular Weight261.19 g/mol
Exact Mass261.11
IUPAC Nameethyl-dimethyl-propylazanium hexafluorophosphate
SMILESCCC[N+](C)(C)CC.F[P-](F)(F)(F)(F)F
InChIInChI=1S/C7H18N.F6P/c1-5-7-8(3,4)6-2;1-7(2,3,4,5)6/h5-7H2,1-4H3;/q+1;-1
InChIKeyNBANKOINPSAYNO-UHFFFAOYSA-N
XLogP4.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.19
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethyl-hexadecyl-dimethylazanium hexafluorophosphate
CID 140503012
dimethyl(dipropyl)azanium chloride
CID 19774441
ethyl-[4-[ethyl(dimethyl)azaniumyl]butyl]-dimethylazanium
CID 25995
butyl-dimethyl-propylazanium;ethane
CID 156736047
bis(trifluoromethylsulfonyl)azanide;ethyl-dimethyl-propylazanium
CID 71310880
diethyl-methoxy-propylazanium hexafluorophosphate
CID 174873592
dodecyl-ethyl-dimethylazanium;hydrate
CID 175307815
2-[2-[dimethyl(propyl)azaniumyl]ethyldisulfanyl]ethyl-dimethyl-propylazanium diiodide
CID 132957393
8-[dimethyl(propyl)azaniumyl]octyl-dimethyl-propylazanium
CID 175720257
hexyl(trimethyl)azanium hexafluorophosphate
CID 121234264
ethyl-dimethyl-(2-propoxyethyl)azanium
CID 87916189
tetrabutylazanium;tetraethylazanium;dihexafluorophosphate
CID 22559466

Frequently Asked Questions

What is the IUPAC name of ethyl-dimethyl-propylazanium hexafluorophosphate?
The IUPAC name of ethyl-dimethyl-propylazanium hexafluorophosphate (CID 140620148) is ethyl-dimethyl-propylazanium hexafluorophosphate.
What is the SMILES notation for ethyl-dimethyl-propylazanium hexafluorophosphate?
The canonical SMILES for ethyl-dimethyl-propylazanium hexafluorophosphate is CCC[N+](C)(C)CC.F[P-](F)(F)(F)(F)F.
What is the InChIKey of ethyl-dimethyl-propylazanium hexafluorophosphate?
The InChIKey is NBANKOINPSAYNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N.F6P/c1-5-7-8(3,4)6-2;1-7(2,3,4,5)6/h5-7H2,1-4H3;/q+1;-1.
What are the key properties of ethyl-dimethyl-propylazanium hexafluorophosphate?
ethyl-dimethyl-propylazanium hexafluorophosphate has a molecular weight of 261.19 g/mol, XLogP of 4.88, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-dimethyl-propylazanium hexafluorophosphate is sourced from PubChem (CID 140620148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).