3-fluoro-2H-pyridine-1-carboxamide

C6H7FN2O — CID 91070082

IUPAC3-fluoro-2H-pyridine-1-carboxamide
SMILESNC(=O)N1C=CC=C(F)C1
InChIInChI=1S/C6H7FN2O/c7-5-2-1-3-9(4-5)6(8)10/h1-3H,4H2,(H2,8,10)
InChIKeyWJXFQKZDSUIKJY-UHFFFAOYSA-N
MW142.13 g/mol
LogP0.75
Rot. Bonds

About 3-fluoro-2H-pyridine-1-carboxamide

3-fluoro-2H-pyridine-1-carboxamide (PubChem CID 91070082) has the molecular formula C6H7FN2O and a molecular weight of 142.13 g/mol. Its IUPAC name is 3-fluoro-2H-pyridine-1-carboxamide.

Molecular Properties

Compound Name3-fluoro-2H-pyridine-1-carboxamide
PubChem CID91070082
Molecular FormulaC6H7FN2O
Molecular Weight142.13 g/mol
Exact Mass142.05
IUPAC Name3-fluoro-2H-pyridine-1-carboxamide
SMILESNC(=O)N1C=CC=C(F)C1
InChIInChI=1S/C6H7FN2O/c7-5-2-1-3-9(4-5)6(8)10/h1-3H,4H2,(H2,8,10)
InChIKeyWJXFQKZDSUIKJY-UHFFFAOYSA-N
XLogP0.75
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.13
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2H-pyridine-1-carboxamide?
The IUPAC name of 3-fluoro-2H-pyridine-1-carboxamide (CID 91070082) is 3-fluoro-2H-pyridine-1-carboxamide.
What is the SMILES notation for 3-fluoro-2H-pyridine-1-carboxamide?
The canonical SMILES for 3-fluoro-2H-pyridine-1-carboxamide is NC(=O)N1C=CC=C(F)C1.
What is the InChIKey of 3-fluoro-2H-pyridine-1-carboxamide?
The InChIKey is WJXFQKZDSUIKJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2O/c7-5-2-1-3-9(4-5)6(8)10/h1-3H,4H2,(H2,8,10).
What are the key properties of 3-fluoro-2H-pyridine-1-carboxamide?
3-fluoro-2H-pyridine-1-carboxamide has a molecular weight of 142.13 g/mol, XLogP of 0.75, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 91070082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).