2-fluoro-3-(3-nitrophenyl)pyridine

C11H7FN2O2 — CID 125425503

IUPAC2-fluoro-3-(3-nitrophenyl)pyridine
SMILESO=[N+]([O-])c1cccc(-c2cccnc2F)c1
InChIInChI=1S/C11H7FN2O2/c12-11-10(5-2-6-13-11)8-3-1-4-9(7-8)14(15)16/h1-7H
InChIKeyITXVMRNHTGUNBA-UHFFFAOYSA-N
MW218.19 g/mol
LogP2.80
Rot. Bonds2

About 2-fluoro-3-(3-nitrophenyl)pyridine

2-fluoro-3-(3-nitrophenyl)pyridine (PubChem CID 125425503) has the molecular formula C11H7FN2O2 and a molecular weight of 218.19 g/mol. Its IUPAC name is 2-fluoro-3-(3-nitrophenyl)pyridine.

Molecular Properties

Compound Name2-fluoro-3-(3-nitrophenyl)pyridine
PubChem CID125425503
Molecular FormulaC11H7FN2O2
Molecular Weight218.19 g/mol
Exact Mass218.05
IUPAC Name2-fluoro-3-(3-nitrophenyl)pyridine
SMILESO=[N+]([O-])c1cccc(-c2cccnc2F)c1
InChIInChI=1S/C11H7FN2O2/c12-11-10(5-2-6-13-11)8-3-1-4-9(7-8)14(15)16/h1-7H
InChIKeyITXVMRNHTGUNBA-UHFFFAOYSA-N
XLogP2.80
TPSA56.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.19
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(3-nitrophenyl)pyridine-3-carbaldehyde
CID 2764566
3-chloro-4-(3-nitrophenyl)pyridazine
CID 174434324
3-nitro-4-(3-nitrophenyl)pyridine
CID 26793007
4-fluoro-2-methyl-1-(3-nitrophenyl)benzene
CID 57155248
8-(3-nitrophenyl)-6-propan-2-ylquinoline;hydrochloride
CID 19381182
1-(3-nitrophenyl)-3-phenylbenzene
CID 12623202
4-(3-nitrophenyl)-8-(trifluoromethyl)quinoline
CID 174518716
4-(3-nitrophenyl)-2,6-dipyridin-2-ylpyridine
CID 12990785
2,6-difluoro-3-(3-nitrophenyl)aniline
CID 165455760
nitric acid;4-(3-nitrophenyl)pyridine
CID 71334650
2,3-bis(3-nitrophenyl)quinoxaline
CID 71350595
2-(3-nitrophenyl)-[1,3]oxazolo[5,4-b]pyridine
CID 14401275

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-(3-nitrophenyl)pyridine?
The IUPAC name of 2-fluoro-3-(3-nitrophenyl)pyridine (CID 125425503) is 2-fluoro-3-(3-nitrophenyl)pyridine.
What is the SMILES notation for 2-fluoro-3-(3-nitrophenyl)pyridine?
The canonical SMILES for 2-fluoro-3-(3-nitrophenyl)pyridine is O=[N+]([O-])c1cccc(-c2cccnc2F)c1.
What is the InChIKey of 2-fluoro-3-(3-nitrophenyl)pyridine?
The InChIKey is ITXVMRNHTGUNBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7FN2O2/c12-11-10(5-2-6-13-11)8-3-1-4-9(7-8)14(15)16/h1-7H.
What are the key properties of 2-fluoro-3-(3-nitrophenyl)pyridine?
2-fluoro-3-(3-nitrophenyl)pyridine has a molecular weight of 218.19 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-(3-nitrophenyl)pyridine is sourced from PubChem (CID 125425503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).