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

C8H7F3N2O — CID 118851932

IUPAC4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide
SMILESCc1nc(C(N)=O)cc(C(F)F)c1F
InChIInChI=1S/C8H7F3N2O/c1-3-6(9)4(7(10)11)2-5(13-3)8(12)14/h2,7H,1H3,(H2,12,14)
InChIKeyZAXAQLGPCQJHNN-UHFFFAOYSA-N
MW204.15 g/mol
LogP1.57
Rot. Bonds2

About 4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide

4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide (PubChem CID 118851932) has the molecular formula C8H7F3N2O and a molecular weight of 204.15 g/mol. Its IUPAC name is 4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide
PubChem CID118851932
Molecular FormulaC8H7F3N2O
Molecular Weight204.15 g/mol
Exact Mass204.05
IUPAC Name4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide
SMILESCc1nc(C(N)=O)cc(C(F)F)c1F
InChIInChI=1S/C8H7F3N2O/c1-3-6(9)4(7(10)11)2-5(13-3)8(12)14/h2,7H,1H3,(H2,12,14)
InChIKeyZAXAQLGPCQJHNN-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

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Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide?
The IUPAC name of 4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide (CID 118851932) is 4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide.
What is the SMILES notation for 4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide?
The canonical SMILES for 4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide is Cc1nc(C(N)=O)cc(C(F)F)c1F.
What is the InChIKey of 4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide?
The InChIKey is ZAXAQLGPCQJHNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N2O/c1-3-6(9)4(7(10)11)2-5(13-3)8(12)14/h2,7H,1H3,(H2,12,14).
What are the key properties of 4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide?
4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-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 4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 118851932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).