2-fluoropyridine-3-carbonitrile

C6H3FN2 — CID 2783254

IUPAC2-fluoropyridine-3-carbonitrile
SMILESN#Cc1cccnc1F
InChIInChI=1S/C6H3FN2/c7-6-5(4-8)2-1-3-9-6/h1-3H
InChIKeyUSIDQCCXMGJOJM-UHFFFAOYSA-N
MW122.10 g/mol
LogP1.09
Rot. Bonds

About 2-fluoropyridine-3-carbonitrile

2-fluoropyridine-3-carbonitrile (PubChem CID 2783254) has the molecular formula C6H3FN2 and a molecular weight of 122.10 g/mol. Its IUPAC name is 2-fluoropyridine-3-carbonitrile.

Molecular Properties

Compound Name2-fluoropyridine-3-carbonitrile
PubChem CID2783254
Molecular FormulaC6H3FN2
Molecular Weight122.10 g/mol
Exact Mass122.03
IUPAC Name2-fluoropyridine-3-carbonitrile
SMILESN#Cc1cccnc1F
InChIInChI=1S/C6H3FN2/c7-6-5(4-8)2-1-3-9-6/h1-3H
InChIKeyUSIDQCCXMGJOJM-UHFFFAOYSA-N
XLogP1.09
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.10
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(3-bromoprop-1-ynyl)-2-fluoropyridine
CID 146626830
ethane;2-(2-fluoro-3-pyridinyl)ethynyl-trimethylsilane
CID 90942554
2-aminopyridine-3-carbonitrile;ethane
CID 144683018
3-bromo-2-fluoropyridine-4-carbonitrile
CID 121227725
2-(diethylamino)pyridine-3-carbonitrile
CID 10012430
quinoline-8-carbonitrile;trihydrochloride
CID 141468212
2-(dichloromethyl)pyridine-3-carbonitrile
CID 86039056
3-(3-amino-2-pyridinyl)-2-fluorobenzonitrile
CID 175711323
2-(3,5-difluoroanilino)pyridine-3-carbonitrile
CID 24703722
2-fluoro-5-[(2-fluoro-3-pyridinyl)oxymethyl]benzonitrile
CID 107889224
4-(2-fluoro-3-pyridinyl)but-3-yn-1-ol
CID 11805111
2-cyclopropylpyridine-3-carbonitrile
CID 57440906

Frequently Asked Questions

What is the IUPAC name of 2-fluoropyridine-3-carbonitrile?
The IUPAC name of 2-fluoropyridine-3-carbonitrile (CID 2783254) is 2-fluoropyridine-3-carbonitrile.
What is the SMILES notation for 2-fluoropyridine-3-carbonitrile?
The canonical SMILES for 2-fluoropyridine-3-carbonitrile is N#Cc1cccnc1F.
What is the InChIKey of 2-fluoropyridine-3-carbonitrile?
The InChIKey is USIDQCCXMGJOJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3FN2/c7-6-5(4-8)2-1-3-9-6/h1-3H.
What are the key properties of 2-fluoropyridine-3-carbonitrile?
2-fluoropyridine-3-carbonitrile has a molecular weight of 122.10 g/mol, XLogP of 1.09, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoropyridine-3-carbonitrile is sourced from PubChem (CID 2783254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).