3-(4-fluorophenoxy)-1H-pyrazin-2-one

C10H7FN2O2 — CID 103241140

IUPAC3-(4-fluorophenoxy)-1H-pyrazin-2-one
SMILESO=c1[nH]ccnc1Oc1ccc(F)cc1
InChIInChI=1S/C10H7FN2O2/c11-7-1-3-8(4-2-7)15-10-9(14)12-5-6-13-10/h1-6H,(H,12,14)
InChIKeyKCZTXAXWLZPFOZ-UHFFFAOYSA-N
MW206.18 g/mol
LogP1.70
Rot. Bonds2

About 3-(4-fluorophenoxy)-1H-pyrazin-2-one

3-(4-fluorophenoxy)-1H-pyrazin-2-one (PubChem CID 103241140) has the molecular formula C10H7FN2O2 and a molecular weight of 206.18 g/mol. Its IUPAC name is 3-(4-fluorophenoxy)-1H-pyrazin-2-one.

Molecular Properties

Compound Name3-(4-fluorophenoxy)-1H-pyrazin-2-one
PubChem CID103241140
Molecular FormulaC10H7FN2O2
Molecular Weight206.18 g/mol
Exact Mass206.05
IUPAC Name3-(4-fluorophenoxy)-1H-pyrazin-2-one
SMILESO=c1[nH]ccnc1Oc1ccc(F)cc1
InChIInChI=1S/C10H7FN2O2/c11-7-1-3-8(4-2-7)15-10-9(14)12-5-6-13-10/h1-6H,(H,12,14)
InChIKeyKCZTXAXWLZPFOZ-UHFFFAOYSA-N
XLogP1.70
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.18
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-ethoxyphenoxy)-1H-pyrazin-2-one
CID 103240950
3-[4-(hydroxymethyl)phenoxy]-1H-pyrazin-2-one
CID 114571100
3-(4-amino-3-fluorophenoxy)-1H-pyrazin-2-one
CID 114570857
3-(4-fluoro-2-methylphenoxy)-1H-pyrazin-2-one
CID 103241890
3-(3-bromo-5-fluorophenoxy)-1H-pyrazin-2-one
CID 114570741
3-(2-bromo-4-fluorophenoxy)-1H-pyrazin-2-one
CID 114570730
3-(2-fluoro-5-methylphenoxy)-1H-pyrazin-2-one
CID 103241750
3-[3-(dimethylamino)phenoxy]-1H-pyrazin-2-one
CID 103241451
2-(4-fluorophenoxy)pyridin-3-ol
CID 59089126
3-(4-bromo-2-methylphenoxy)-1H-pyrazin-2-one
CID 114570737
2-(4-fluorophenoxy)pyridine-3-carboxylic acid
CID 605123
3-(5-amino-2-methoxyphenoxy)-1H-pyrazin-2-one
CID 114570848

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenoxy)-1H-pyrazin-2-one?
The IUPAC name of 3-(4-fluorophenoxy)-1H-pyrazin-2-one (CID 103241140) is 3-(4-fluorophenoxy)-1H-pyrazin-2-one.
What is the SMILES notation for 3-(4-fluorophenoxy)-1H-pyrazin-2-one?
The canonical SMILES for 3-(4-fluorophenoxy)-1H-pyrazin-2-one is O=c1[nH]ccnc1Oc1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenoxy)-1H-pyrazin-2-one?
The InChIKey is KCZTXAXWLZPFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN2O2/c11-7-1-3-8(4-2-7)15-10-9(14)12-5-6-13-10/h1-6H,(H,12,14).
What are the key properties of 3-(4-fluorophenoxy)-1H-pyrazin-2-one?
3-(4-fluorophenoxy)-1H-pyrazin-2-one has a molecular weight of 206.18 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenoxy)-1H-pyrazin-2-one is sourced from PubChem (CID 103241140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).