5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine

C10H7FN4O3 — CID 80663467

IUPAC5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine
SMILESNc1cnc(Oc2cc(F)ccc2[N+](=O)[O-])cn1
InChIInChI=1S/C10H7FN4O3/c11-6-1-2-7(15(16)17)8(3-6)18-10-5-13-9(12)4-14-10/h1-5H,(H2,12,13)
InChIKeyLVZFEXDCZWZUIS-UHFFFAOYSA-N
MW250.19 g/mol
LogP1.90
Rot. Bonds3

About 5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine

5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine (PubChem CID 80663467) has the molecular formula C10H7FN4O3 and a molecular weight of 250.19 g/mol. Its IUPAC name is 5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine.

Molecular Properties

Compound Name5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine
PubChem CID80663467
Molecular FormulaC10H7FN4O3
Molecular Weight250.19 g/mol
Exact Mass250.05
IUPAC Name5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine
SMILESNc1cnc(Oc2cc(F)ccc2[N+](=O)[O-])cn1
InChIInChI=1S/C10H7FN4O3/c11-6-1-2-7(15(16)17)8(3-6)18-10-5-13-9(12)4-14-10/h1-5H,(H2,12,13)
InChIKeyLVZFEXDCZWZUIS-UHFFFAOYSA-N
XLogP1.90
TPSA104.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.19
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-(2-methyl-3-nitrophenoxy)pyrazin-2-amine
CID 80663589
5-(8-nitroquinolin-5-yl)oxypyrazin-2-amine
CID 116525775
[6-(5-fluoro-2-nitrophenoxy)pyrimidin-4-yl]hydrazine
CID 80920512
1-[6-(5-fluoro-2-nitrophenoxy)-3-pyridinyl]-N-methylmethanamine
CID 80633902
2-(5-fluoro-2-nitrophenoxy)pyridin-3-amine
CID 114051796
3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine
CID 60674957
6-(5-fluoro-2-nitrophenoxy)pyrazine-2-carboxylic acid
CID 66458082
5-(2,4-dimethyl-6-nitrophenoxy)pyrazin-2-amine
CID 80664421
4-fluoro-2-[3-(5-fluoro-2-nitrophenoxy)propoxy]-1-nitrobenzene
CID 7533666
2-(2-bromo-5-fluorophenoxy)-5-methyl-4-nitropyridine
CID 83267572
3-bromo-2-(5-fluoro-2-nitrophenoxy)-5-methylpyridine
CID 105368287
5-bromo-2-chloro-4-(5-fluoro-2-nitrophenoxy)pyrimidine
CID 79075513

Frequently Asked Questions

What is the IUPAC name of 5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine?
The IUPAC name of 5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine (CID 80663467) is 5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine.
What is the SMILES notation for 5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine?
The canonical SMILES for 5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine is Nc1cnc(Oc2cc(F)ccc2[N+](=O)[O-])cn1.
What is the InChIKey of 5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine?
The InChIKey is LVZFEXDCZWZUIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN4O3/c11-6-1-2-7(15(16)17)8(3-6)18-10-5-13-9(12)4-14-10/h1-5H,(H2,12,13).
What are the key properties of 5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine?
5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine has a molecular weight of 250.19 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine is sourced from PubChem (CID 80663467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).