5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide

C17H10F4N4O — CID 109294504

IUPAC5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1cnc(Nc2c(F)cccc2F)cn1
InChIInChI=1S/C17H10F4N4O/c18-9-4-5-13(12(21)6-9)24-17(26)14-7-23-15(8-22-14)25-16-10(19)2-1-3-11(16)20/h1-8H,(H,23,25)(H,24,26)
InChIKeyYLGKAOPCEWJMLF-UHFFFAOYSA-N
MW362.29 g/mol
LogP4.03
Rot. Bonds4

About 5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide

5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide (PubChem CID 109294504) has the molecular formula C17H10F4N4O and a molecular weight of 362.29 g/mol. Its IUPAC name is 5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide
PubChem CID109294504
Molecular FormulaC17H10F4N4O
Molecular Weight362.29 g/mol
Exact Mass362.08
IUPAC Name5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1cnc(Nc2c(F)cccc2F)cn1
InChIInChI=1S/C17H10F4N4O/c18-9-4-5-13(12(21)6-9)24-17(26)14-7-23-15(8-22-14)25-16-10(19)2-1-3-11(16)20/h1-8H,(H,23,25)(H,24,26)
InChIKeyYLGKAOPCEWJMLF-UHFFFAOYSA-N
XLogP4.03
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.29
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2,6-difluoroanilino)-N-(2,4-dimethylphenyl)pyrazine-2-carboxamide
CID 109290763
N-(2,3-dichlorophenyl)-5-(2,4-difluoroanilino)pyrazine-2-carboxamide
CID 109294513
5-(3,4-dichloroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide
CID 109294492
N-(2,3-dichlorophenyl)-5-(2,6-difluoroanilino)pyrazine-2-carboxamide
CID 109294623
N-(2,4-difluorophenyl)-5-(2-propan-2-ylanilino)pyrazine-2-carboxamide
CID 109291993
N-(2,4-difluorophenyl)-5-(4-ethylanilino)pyrazine-2-carboxamide
CID 109291695
N-(2,5-dichlorophenyl)-5-(2,4-difluoroanilino)pyrazine-2-carboxamide
CID 109294510
N-(2,4-difluorophenyl)-5-(2-propan-2-yloxyanilino)pyrazine-2-carboxamide
CID 109293851
5-(2,4-difluoroanilino)-N-(2,4,6-trimethylphenyl)pyrazine-2-carboxamide
CID 109292112
N-(2,4-difluorophenyl)-5-[2-(4-fluorophenyl)ethylamino]pyrazine-2-carboxamide
CID 109284577
5-(2-fluoroanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109292440
5-(2,6-difluoroanilino)-N-propan-2-ylpyrazine-2-carboxamide
CID 109271349

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide (CID 109294504) is 5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide is O=C(Nc1ccc(F)cc1F)c1cnc(Nc2c(F)cccc2F)cn1.
What is the InChIKey of 5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide?
The InChIKey is YLGKAOPCEWJMLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10F4N4O/c18-9-4-5-13(12(21)6-9)24-17(26)14-7-23-15(8-22-14)25-16-10(19)2-1-3-11(16)20/h1-8H,(H,23,25)(H,24,26).
What are the key properties of 5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide?
5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide has a molecular weight of 362.29 g/mol, XLogP of 4.03, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-difluoroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109294504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).