6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine

C11H8FN3O3 — CID 80653072

IUPAC6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine
SMILESNc1cccc(Oc2ccc([N+](=O)[O-])cc2F)n1
InChIInChI=1S/C11H8FN3O3/c12-8-6-7(15(16)17)4-5-9(8)18-11-3-1-2-10(13)14-11/h1-6H,(H2,13,14)
InChIKeyNMWHEEHHXYTEHY-UHFFFAOYSA-N
MW249.20 g/mol
LogP2.50
Rot. Bonds3

About 6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine

6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine (PubChem CID 80653072) has the molecular formula C11H8FN3O3 and a molecular weight of 249.20 g/mol. Its IUPAC name is 6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine.

Molecular Properties

Compound Name6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine
PubChem CID80653072
Molecular FormulaC11H8FN3O3
Molecular Weight249.20 g/mol
Exact Mass249.05
IUPAC Name6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine
SMILESNc1cccc(Oc2ccc([N+](=O)[O-])cc2F)n1
InChIInChI=1S/C11H8FN3O3/c12-8-6-7(15(16)17)4-5-9(8)18-11-3-1-2-10(13)14-11/h1-6H,(H2,13,14)
InChIKeyNMWHEEHHXYTEHY-UHFFFAOYSA-N
XLogP2.50
TPSA91.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.20
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

6-(2-fluoro-4-nitrophenoxy)pyrimidine-2,4-diamine
CID 80871675
4-(2-fluoro-4-nitrophenoxy)-6-methylpyrimidine
CID 143321178
(1R)-1-[2-fluoro-6-(2-fluoro-4-nitrophenoxy)phenyl]ethanamine
CID 63370027
2-fluoro-6-(2-methoxy-5-nitrophenoxy)pyridine
CID 61227798
4-(2-fluoro-4-nitrophenoxy)-6-methoxy-1,3,5-triazin-2-amine
CID 80870869
2-(2-fluoro-4-nitrophenoxy)phenol
CID 60869522
5-(2-fluoro-4-nitrophenoxy)-2,3-dimethylquinoxaline
CID 141314832
2-(2-fluoro-4-nitrophenoxy)-1-methoxy-4-nitrobenzene
CID 154791901
2-fluoro-6-(2-fluoro-4-nitrophenoxy)benzoic acid
CID 79515985
(1S)-1-[4-(2-fluoro-4-nitrophenoxy)phenyl]ethanamine
CID 63370003
2-bromo-6-(2-chloro-4-nitrophenoxy)pyridine
CID 63963412
2-(2-fluoro-4-nitrophenoxy)pyridine-4-carboxylic acid
CID 61038317

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine?
The IUPAC name of 6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine (CID 80653072) is 6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine.
What is the SMILES notation for 6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine?
The canonical SMILES for 6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine is Nc1cccc(Oc2ccc([N+](=O)[O-])cc2F)n1.
What is the InChIKey of 6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine?
The InChIKey is NMWHEEHHXYTEHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FN3O3/c12-8-6-7(15(16)17)4-5-9(8)18-11-3-1-2-10(13)14-11/h1-6H,(H2,13,14).
What are the key properties of 6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine?
6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine has a molecular weight of 249.20 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-4-nitrophenoxy)pyridin-2-amine is sourced from PubChem (CID 80653072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).