6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione

C9H6FN3O2 — CID 83128935

IUPAC6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione
SMILESO=c1cc(-c2ccc(F)cn2)[nH]c(=O)[nH]1
InChIInChI=1S/C9H6FN3O2/c10-5-1-2-6(11-4-5)7-3-8(14)13-9(15)12-7/h1-4H,(H2,12,13,14,15)
InChIKeyBFPXFXNZCFDZLK-UHFFFAOYSA-N
MW207.16 g/mol
LogP0.26
Rot. Bonds1

About 6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione

6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione (PubChem CID 83128935) has the molecular formula C9H6FN3O2 and a molecular weight of 207.16 g/mol. Its IUPAC name is 6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione
PubChem CID83128935
Molecular FormulaC9H6FN3O2
Molecular Weight207.16 g/mol
Exact Mass207.04
IUPAC Name6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione
SMILESO=c1cc(-c2ccc(F)cn2)[nH]c(=O)[nH]1
InChIInChI=1S/C9H6FN3O2/c10-5-1-2-6(11-4-5)7-3-8(14)13-9(15)12-7/h1-4H,(H2,12,13,14,15)
InChIKeyBFPXFXNZCFDZLK-UHFFFAOYSA-N
XLogP0.26
TPSA78.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.16
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-fluoro-2-pyridinyl)-1,3-dihydroimidazole-2-thione
CID 83128948
8-(5-fluoro-2-pyridinyl)-3,7-dihydropurine-2,6-dione
CID 114402872
6-[[4-(4-fluorophenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione
CID 4532593
N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide
CID 169097714
6-(2-sulfanylphenyl)-1H-pyrimidine-2,4-dione
CID 70626224
5-fluoro-2-(2,4,6-trichlorophenyl)pyridine
CID 133090364
2-(2,4-difluorophenyl)-5-fluoropyridine
CID 130334925
6-(2-fluoro-6-methoxyphenyl)-1H-pyrimidine-2,4-dione
CID 113389395
7-(5-fluoro-2-pyridinyl)-8-iodo-6-(trifluoromethyl)-1H-quinazoline-2,4-dione
CID 164541776
2-(5-fluoro-2-pyridinyl)-1H-imidazole-5-carboxylic acid
CID 79717873
6-[5-(5-fluoro-2-pyridinyl)-1H-imidazol-2-yl]hexan-1-amine
CID 83125480
6-(4-aminophenyl)-1H-pyrimidine-2,4-dione
CID 20980738

Frequently Asked Questions

What is the IUPAC name of 6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione?
The IUPAC name of 6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione (CID 83128935) is 6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione?
The canonical SMILES for 6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione is O=c1cc(-c2ccc(F)cn2)[nH]c(=O)[nH]1.
What is the InChIKey of 6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione?
The InChIKey is BFPXFXNZCFDZLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6FN3O2/c10-5-1-2-6(11-4-5)7-3-8(14)13-9(15)12-7/h1-4H,(H2,12,13,14,15).
What are the key properties of 6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione?
6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione has a molecular weight of 207.16 g/mol, XLogP of 0.26, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-fluoro-2-pyridinyl)-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 83128935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).