1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium

C10H8F2N2+2 — CID 2733932

IUPAC1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium
SMILESF[n+]1ccccc1-c1cccc[n+]1F
InChIInChI=1S/C10H8F2N2/c11-13-7-3-1-5-9(13)10-6-2-4-8-14(10)12/h1-8H/q+2
InChIKeyVWXNMFVNVKSKOB-UHFFFAOYSA-N
MW194.18 g/mol
LogP1.39
Rot. Bonds1

About 1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium

1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium (PubChem CID 2733932) has the molecular formula C10H8F2N2+2 and a molecular weight of 194.18 g/mol. Its IUPAC name is 1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium.

Molecular Properties

Compound Name1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium
PubChem CID2733932
Molecular FormulaC10H8F2N2+2
Molecular Weight194.18 g/mol
Exact Mass194.06
IUPAC Name1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium
SMILESF[n+]1ccccc1-c1cccc[n+]1F
InChIInChI=1S/C10H8F2N2/c11-13-7-3-1-5-9(13)10-6-2-4-8-14(10)12/h1-8H/q+2
InChIKeyVWXNMFVNVKSKOB-UHFFFAOYSA-N
XLogP1.39
TPSA7.76 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.18
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium?
The IUPAC name of 1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium (CID 2733932) is 1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium.
What is the SMILES notation for 1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium?
The canonical SMILES for 1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium is F[n+]1ccccc1-c1cccc[n+]1F.
What is the InChIKey of 1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium?
The InChIKey is VWXNMFVNVKSKOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F2N2/c11-13-7-3-1-5-9(13)10-6-2-4-8-14(10)12/h1-8H/q+2.
What are the key properties of 1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium?
1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium has a molecular weight of 194.18 g/mol, XLogP of 1.39, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium is sourced from PubChem (CID 2733932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).