6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide

C8H4F3N3O — CID 118992430

IUPAC6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide
SMILESN#Cc1nc(C(N)=O)cc(F)c1C(F)F
InChIInChI=1S/C8H4F3N3O/c9-3-1-4(8(13)15)14-5(2-12)6(3)7(10)11/h1,7H,(H2,13,15)
InChIKeyBOTKUXNXEZPLHX-UHFFFAOYSA-N
MW215.13 g/mol
LogP1.13
Rot. Bonds2

About 6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide

6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide (PubChem CID 118992430) has the molecular formula C8H4F3N3O and a molecular weight of 215.13 g/mol. Its IUPAC name is 6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide.

Molecular Properties

Compound Name6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide
PubChem CID118992430
Molecular FormulaC8H4F3N3O
Molecular Weight215.13 g/mol
Exact Mass215.03
IUPAC Name6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide
SMILESN#Cc1nc(C(N)=O)cc(F)c1C(F)F
InChIInChI=1S/C8H4F3N3O/c9-3-1-4(8(13)15)14-5(2-12)6(3)7(10)11/h1,7H,(H2,13,15)
InChIKeyBOTKUXNXEZPLHX-UHFFFAOYSA-N
XLogP1.13
TPSA79.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.13
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-cyano-4-(difluoromethyl)-5-fluoropyridine-2-carboxamide
CID 119024543
6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide
CID 119015693
ethyl 6-cyano-5-(difluoromethyl)-4-iodopyridine-2-carboxylate
CID 134684998
5-(difluoromethyl)-4,6-dimethylpyridine-2-carboxamide
CID 130101518
2-[6-cyano-5-(difluoromethyl)-4-iodo-2-pyridinyl]acetic acid
CID 118999551
4-chloro-3-(difluoromethyl)-6-fluoropyridine-2-carbonitrile
CID 118845275
2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide
CID 118995384
2-cyano-3-(difluoromethyl)-6-fluoropyridine-4-sulfonamide
CID 118993918
6-bromo-2-cyano-3-(difluoromethyl)pyridine-4-carboxylic acid
CID 130109023
3-(difluoromethyl)-4-fluoro-6-methylpyridine-2-carboxamide
CID 130081330
6-bromo-2-cyano-3-(difluoromethyl)pyridine-4-carbonyl chloride
CID 134662971
6-cyano-5-(difluoromethyl)-2-iodopyridine-3-carboxamide
CID 119006178

Frequently Asked Questions

What is the IUPAC name of 6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide?
The IUPAC name of 6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide (CID 118992430) is 6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide.
What is the SMILES notation for 6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide?
The canonical SMILES for 6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide is N#Cc1nc(C(N)=O)cc(F)c1C(F)F.
What is the InChIKey of 6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide?
The InChIKey is BOTKUXNXEZPLHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4F3N3O/c9-3-1-4(8(13)15)14-5(2-12)6(3)7(10)11/h1,7H,(H2,13,15).
What are the key properties of 6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide?
6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide has a molecular weight of 215.13 g/mol, XLogP of 1.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide is sourced from PubChem (CID 118992430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).