6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide

C8H7F3N2O — CID 118814860

IUPAC6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide
SMILESCc1cc(C(N)=O)c(F)nc1C(F)F
InChIInChI=1S/C8H7F3N2O/c1-3-2-4(8(12)14)7(11)13-5(3)6(9)10/h2,6H,1H3,(H2,12,14)
InChIKeyLOSJWESANBVJSV-UHFFFAOYSA-N
MW204.15 g/mol
LogP1.57
Rot. Bonds2

About 6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide

6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide (PubChem CID 118814860) has the molecular formula C8H7F3N2O and a molecular weight of 204.15 g/mol. Its IUPAC name is 6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide
PubChem CID118814860
Molecular FormulaC8H7F3N2O
Molecular Weight204.15 g/mol
Exact Mass204.05
IUPAC Name6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide
SMILESCc1cc(C(N)=O)c(F)nc1C(F)F
InChIInChI=1S/C8H7F3N2O/c1-3-2-4(8(12)14)7(11)13-5(3)6(9)10/h2,6H,1H3,(H2,12,14)
InChIKeyLOSJWESANBVJSV-UHFFFAOYSA-N
XLogP1.57
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.15
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 6-(difluoromethyl)-2-fluoro-5-methylpyridine-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-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide?
The IUPAC name of 6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide (CID 118814860) is 6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide.
What is the SMILES notation for 6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide?
The canonical SMILES for 6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide is Cc1cc(C(N)=O)c(F)nc1C(F)F.
What is the InChIKey of 6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide?
The InChIKey is LOSJWESANBVJSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N2O/c1-3-2-4(8(12)14)7(11)13-5(3)6(9)10/h2,6H,1H3,(H2,12,14).
What are the key properties of 6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide?
6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide has a molecular weight of 204.15 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide is sourced from PubChem (CID 118814860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).