6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide

C10H7FN4O — CID 104856868

IUPAC6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide
SMILESO=C(Nc1cncnc1)c1ccc(F)nc1
InChIInChI=1S/C10H7FN4O/c11-9-2-1-7(3-14-9)10(16)15-8-4-12-6-13-5-8/h1-6H,(H,15,16)
InChIKeyPOYXSSNWLSHOLX-UHFFFAOYSA-N
MW218.19 g/mol
LogP1.26
Rot. Bonds2

About 6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide

6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide (PubChem CID 104856868) has the molecular formula C10H7FN4O and a molecular weight of 218.19 g/mol. Its IUPAC name is 6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide
PubChem CID104856868
Molecular FormulaC10H7FN4O
Molecular Weight218.19 g/mol
Exact Mass218.06
IUPAC Name6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide
SMILESO=C(Nc1cncnc1)c1ccc(F)nc1
InChIInChI=1S/C10H7FN4O/c11-9-2-1-7(3-14-9)10(16)15-8-4-12-6-13-5-8/h1-6H,(H,15,16)
InChIKeyPOYXSSNWLSHOLX-UHFFFAOYSA-N
XLogP1.26
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.19
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 6-fluoro-N-pyrimidin-5-ylpyridine-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

Related Compounds

4-hydroxy-N-pyrimidin-5-ylbenzamide
CID 104862675
6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide
CID 63979934
6-fluoro-N-pyrazin-2-ylpyridine-3-carboxamide
CID 63971040
6-fluoro-N-[6-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide
CID 82707407
6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide
CID 63972736
N-pyrimidin-5-ylbenzamide
CID 68971843
N-[4-(diethylamino)phenyl]-6-fluoropyridine-3-carboxamide
CID 63973943
4-tert-butyl-N-pyrimidin-5-ylbenzamide
CID 76848988
N-(3-acetamido-4-fluorophenyl)-6-fluoropyridine-3-carboxamide
CID 63971441
N-(3-cyano-4-fluorophenyl)-6-fluoropyridine-3-carboxamide
CID 63978798
N-(6-chloro-5-methyl-3-pyridinyl)-6-fluoropyridine-3-carboxamide
CID 103745328
N-(6-fluoro-3-pyridinyl)-4-(trifluoromethyl)benzamide
CID 103789776

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide?
The IUPAC name of 6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide (CID 104856868) is 6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide.
What is the SMILES notation for 6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide?
The canonical SMILES for 6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide is O=C(Nc1cncnc1)c1ccc(F)nc1.
What is the InChIKey of 6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide?
The InChIKey is POYXSSNWLSHOLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN4O/c11-9-2-1-7(3-14-9)10(16)15-8-4-12-6-13-5-8/h1-6H,(H,15,16).
What are the key properties of 6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide?
6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide has a molecular weight of 218.19 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-pyrimidin-5-ylpyridine-3-carboxamide is sourced from PubChem (CID 104856868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).