furan;1H-pyrimidine-2,4-dione;hydrofluoride

C8H9FN2O3 — CID 174970267

IUPACfuran;1H-pyrimidine-2,4-dione;hydrofluoride
SMILESF.O=c1cc[nH]c(=O)[nH]1.c1ccoc1
InChIInChI=1S/C4H4N2O2.C4H4O.FH/c7-3-1-2-5-4(8)6-3;1-2-4-5-3-1;/h1-2H,(H2,5,6,7,8);1-4H;1H
InChIKeyXBXDUXYOURGAPT-UHFFFAOYSA-N
MW200.17 g/mol
LogP0.50
Rot. Bonds

About furan;1H-pyrimidine-2,4-dione;hydrofluoride

furan;1H-pyrimidine-2,4-dione;hydrofluoride (PubChem CID 174970267) has the molecular formula C8H9FN2O3 and a molecular weight of 200.17 g/mol. Its IUPAC name is furan;1H-pyrimidine-2,4-dione;hydrofluoride.

Molecular Properties

Compound Namefuran;1H-pyrimidine-2,4-dione;hydrofluoride
PubChem CID174970267
Molecular FormulaC8H9FN2O3
Molecular Weight200.17 g/mol
Exact Mass200.06
IUPAC Namefuran;1H-pyrimidine-2,4-dione;hydrofluoride
SMILESF.O=c1cc[nH]c(=O)[nH]1.c1ccoc1
InChIInChI=1S/C4H4N2O2.C4H4O.FH/c7-3-1-2-5-4(8)6-3;1-2-4-5-3-1;/h1-2H,(H2,5,6,7,8);1-4H;1H
InChIKeyXBXDUXYOURGAPT-UHFFFAOYSA-N
XLogP0.50
TPSA78.86 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.17
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Furan;imidazolidine-2,4-dione
CID 66721824
5-fluoro-1H-pyrimidine-2,4-dione;furan
CID 67100299
furan;1H-pyridin-2-one
CID 68696442
furan;1H-pyrimidine-2,4-dione
CID 69571627
1-Fluoropyrimidine-2,4-dione;furan
CID 87268948
3-fluoro-1H-pyrimidine-2,4-dione;furan
CID 87268949
Furan;1,2,3,4-tetrahydropyrimidine
CID 162239059
1,2-Dihydropyridine;furan
CID 174363557
1-(Furan-3-ylmethyl)pyrimidine-2,4-dione
CID 83183011

Frequently Asked Questions

What is the IUPAC name of furan;1H-pyrimidine-2,4-dione;hydrofluoride?
The IUPAC name of furan;1H-pyrimidine-2,4-dione;hydrofluoride (CID 174970267) is furan;1H-pyrimidine-2,4-dione;hydrofluoride.
What is the SMILES notation for furan;1H-pyrimidine-2,4-dione;hydrofluoride?
The canonical SMILES for furan;1H-pyrimidine-2,4-dione;hydrofluoride is F.O=c1cc[nH]c(=O)[nH]1.c1ccoc1.
What is the InChIKey of furan;1H-pyrimidine-2,4-dione;hydrofluoride?
The InChIKey is XBXDUXYOURGAPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N2O2.C4H4O.FH/c7-3-1-2-5-4(8)6-3;1-2-4-5-3-1;/h1-2H,(H2,5,6,7,8);1-4H;1H.
What are the key properties of furan;1H-pyrimidine-2,4-dione;hydrofluoride?
furan;1H-pyrimidine-2,4-dione;hydrofluoride has a molecular weight of 200.17 g/mol, XLogP of 0.50, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan;1H-pyrimidine-2,4-dione;hydrofluoride is sourced from PubChem (CID 174970267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).