N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide

C12H6F4N2O — CID 105380320

IUPACN-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide
SMILESO=C(Nc1c(F)cccc1F)c1ccnc(F)c1F
InChIInChI=1S/C12H6F4N2O/c13-7-2-1-3-8(14)10(7)18-12(19)6-4-5-17-11(16)9(6)15/h1-5H,(H,18,19)
InChIKeyQXMSFSJIWIQJDP-UHFFFAOYSA-N
MW270.19 g/mol
LogP2.89
Rot. Bonds2

About N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide

N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide (PubChem CID 105380320) has the molecular formula C12H6F4N2O and a molecular weight of 270.19 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide
PubChem CID105380320
Molecular FormulaC12H6F4N2O
Molecular Weight270.19 g/mol
Exact Mass270.04
IUPAC NameN-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide
SMILESO=C(Nc1c(F)cccc1F)c1ccnc(F)c1F
InChIInChI=1S/C12H6F4N2O/c13-7-2-1-3-8(14)10(7)18-12(19)6-4-5-17-11(16)9(6)15/h1-5H,(H,18,19)
InChIKeyQXMSFSJIWIQJDP-UHFFFAOYSA-N
XLogP2.89
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.19
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-bromo-6-fluorophenyl)-2,3-difluoropyridine-4-carboxamide
CID 107470490
2-amino-N-(2,6-difluorophenyl)-3-fluoropyridine-4-carboxamide
CID 105384666
N-(4-chlorophenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380159
2,3-difluoro-N-(2,3,5-trifluorophenyl)pyridine-4-carboxamide
CID 105381162
N-[4-(carbamoylamino)phenyl]-2,3-difluoropyridine-4-carboxamide
CID 105380731
2,3-difluoro-N-(4-methylphenyl)pyridine-4-carboxamide
CID 105380183
N-(2,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide
CID 62241635
N-(2,5-difluoro-4-methylphenyl)-2,3-difluoropyridine-4-carboxamide
CID 103585463
N-(2-chloro-6-fluorophenyl)-2-(ethylamino)-3-fluoropyridine-4-carboxamide
CID 105387655
2,3-difluoro-N-(3-hydroxypropyl)pyridine-4-carboxamide
CID 105380583
2,3-difluoro-N-(3-nitrophenyl)pyridine-4-carboxamide
CID 105380312
2,3-difluoro-N-quinoxalin-6-ylpyridine-4-carboxamide
CID 105380445

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide?
The IUPAC name of N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide (CID 105380320) is N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide?
The canonical SMILES for N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide is O=C(Nc1c(F)cccc1F)c1ccnc(F)c1F.
What is the InChIKey of N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide?
The InChIKey is QXMSFSJIWIQJDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6F4N2O/c13-7-2-1-3-8(14)10(7)18-12(19)6-4-5-17-11(16)9(6)15/h1-5H,(H,18,19).
What are the key properties of N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide?
N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide has a molecular weight of 270.19 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide is sourced from PubChem (CID 105380320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).