2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide

C11H7F2N3O — CID 107358891

IUPAC2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(F)nc1)c1cccnc1F
InChIInChI=1S/C11H7F2N3O/c12-9-4-3-7(6-15-9)16-11(17)8-2-1-5-14-10(8)13/h1-6H,(H,16,17)
InChIKeyUWAAYCAZWPYMRW-UHFFFAOYSA-N
MW235.19 g/mol
LogP2.01
Rot. Bonds2

About 2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide

2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide (PubChem CID 107358891) has the molecular formula C11H7F2N3O and a molecular weight of 235.19 g/mol. Its IUPAC name is 2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide
PubChem CID107358891
Molecular FormulaC11H7F2N3O
Molecular Weight235.19 g/mol
Exact Mass235.06
IUPAC Name2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(F)nc1)c1cccnc1F
InChIInChI=1S/C11H7F2N3O/c12-9-4-3-7(6-15-9)16-11(17)8-2-1-5-14-10(8)13/h1-6H,(H,16,17)
InChIKeyUWAAYCAZWPYMRW-UHFFFAOYSA-N
XLogP2.01
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.19
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide (CID 107358891) is 2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide is O=C(Nc1ccc(F)nc1)c1cccnc1F.
What is the InChIKey of 2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide?
The InChIKey is UWAAYCAZWPYMRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7F2N3O/c12-9-4-3-7(6-15-9)16-11(17)8-2-1-5-14-10(8)13/h1-6H,(H,16,17).
What are the key properties of 2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide?
2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide has a molecular weight of 235.19 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 107358891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).