6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide

C9H7FN4O — CID 63971027

IUPAC6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide
SMILESO=C(Nc1cn[nH]c1)c1ccc(F)nc1
InChIInChI=1S/C9H7FN4O/c10-8-2-1-6(3-11-8)9(15)14-7-4-12-13-5-7/h1-5H,(H,12,13)(H,14,15)
InChIKeyNFMZHXFKTJDKHM-UHFFFAOYSA-N
MW206.18 g/mol
LogP1.20
Rot. Bonds2

About 6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide

6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide (PubChem CID 63971027) has the molecular formula C9H7FN4O and a molecular weight of 206.18 g/mol. Its IUPAC name is 6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide
PubChem CID63971027
Molecular FormulaC9H7FN4O
Molecular Weight206.18 g/mol
Exact Mass206.06
IUPAC Name6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide
SMILESO=C(Nc1cn[nH]c1)c1ccc(F)nc1
InChIInChI=1S/C9H7FN4O/c10-8-2-1-6(3-11-8)9(15)14-7-4-12-13-5-7/h1-5H,(H,12,13)(H,14,15)
InChIKeyNFMZHXFKTJDKHM-UHFFFAOYSA-N
XLogP1.20
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.18
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide?
The IUPAC name of 6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide (CID 63971027) is 6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide is O=C(Nc1cn[nH]c1)c1ccc(F)nc1.
What is the InChIKey of 6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide?
The InChIKey is NFMZHXFKTJDKHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7FN4O/c10-8-2-1-6(3-11-8)9(15)14-7-4-12-13-5-7/h1-5H,(H,12,13)(H,14,15).
What are the key properties of 6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide?
6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide has a molecular weight of 206.18 g/mol, XLogP of 1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(1H-pyrazol-4-yl)pyridine-3-carboxamide is sourced from PubChem (CID 63971027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).