octadec-1-enylazanium fluoride

C18H38FN — CID 76551116

IUPACoctadec-1-enylazanium fluoride
SMILESCCCCCCCCCCCCCCCCC=C[NH3+].[F-]
InChIInChI=1S/C18H37N.FH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;/h17-18H,2-16,19H2,1H3;1H
InChIKeyVVZFZHROKHLRJT-UHFFFAOYSA-N
MW287.51 g/mol
LogP2.62
Rot. Bonds15

About octadec-1-enylazanium fluoride

octadec-1-enylazanium fluoride (PubChem CID 76551116) has the molecular formula C18H38FN and a molecular weight of 287.51 g/mol. Its IUPAC name is octadec-1-enylazanium fluoride.

Molecular Properties

Compound Nameoctadec-1-enylazanium fluoride
PubChem CID76551116
Molecular FormulaC18H38FN
Molecular Weight287.51 g/mol
Exact Mass287.30
IUPAC Nameoctadec-1-enylazanium fluoride
SMILESCCCCCCCCCCCCCCCCC=C[NH3+].[F-]
InChIInChI=1S/C18H37N.FH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;/h17-18H,2-16,19H2,1H3;1H
InChIKeyVVZFZHROKHLRJT-UHFFFAOYSA-N
XLogP2.62
TPSA27.64 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.51
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Octadecenylamin
CID 6365325
Octadecadienylamin
CID 15607138
Oktadecenylaminhydrofluorid
CID 19802224
Decenyl amine
CID 21420709
Nonenamine
CID 53653245
N-eicosa-tetraenylamine
CID 88737377
Octadecenylamine
CID 3015223
Heptadec-1-en-1-amine
CID 72745219
Tetracos-1-en-1-amine
CID 73791804
Nonadecenyl amine hydrochloride
CID 129726996
m-Hexamethylene-propyleneamine
CID 129846542
16-Methylheptadec-1-en-1-amine
CID 170848344

Frequently Asked Questions

What is the IUPAC name of octadec-1-enylazanium fluoride?
The IUPAC name of octadec-1-enylazanium fluoride (CID 76551116) is octadec-1-enylazanium fluoride.
What is the SMILES notation for octadec-1-enylazanium fluoride?
The canonical SMILES for octadec-1-enylazanium fluoride is CCCCCCCCCCCCCCCCC=C[NH3+].[F-].
What is the InChIKey of octadec-1-enylazanium fluoride?
The InChIKey is VVZFZHROKHLRJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37N.FH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;/h17-18H,2-16,19H2,1H3;1H.
What are the key properties of octadec-1-enylazanium fluoride?
octadec-1-enylazanium fluoride has a molecular weight of 287.51 g/mol, XLogP of 2.62, 15 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for octadec-1-enylazanium fluoride is sourced from PubChem (CID 76551116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).