N-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide

C19H16F2N4O — CID 109290960

IUPACN-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide
SMILESCc1ccc(C)c(Nc2cnc(C(=O)Nc3c(F)cccc3F)cn2)c1
InChIInChI=1S/C19H16F2N4O/c1-11-6-7-12(2)15(8-11)24-17-10-22-16(9-23-17)19(26)25-18-13(20)4-3-5-14(18)21/h3-10H,1-2H3,(H,23,24)(H,25,26)
InChIKeyZYRVTQNETXRCHV-UHFFFAOYSA-N
MW354.36 g/mol
LogP4.37
Rot. Bonds4

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

N-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide (PubChem CID 109290960) has the molecular formula C19H16F2N4O and a molecular weight of 354.36 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide
PubChem CID109290960
Molecular FormulaC19H16F2N4O
Molecular Weight354.36 g/mol
Exact Mass354.13
IUPAC NameN-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide
SMILESCc1ccc(C)c(Nc2cnc(C(=O)Nc3c(F)cccc3F)cn2)c1
InChIInChI=1S/C19H16F2N4O/c1-11-6-7-12(2)15(8-11)24-17-10-22-16(9-23-17)19(26)25-18-13(20)4-3-5-14(18)21/h3-10H,1-2H3,(H,23,24)(H,25,26)
InChIKeyZYRVTQNETXRCHV-UHFFFAOYSA-N
XLogP4.37
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.36
LogP ≤ 54.37
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-(2,6-difluorophenyl)-6-(2,5-dimethylanilino)pyridazine-3-carboxamide
CID 109127605
N-(2,6-difluorophenyl)-2-(2,5-dimethylanilino)pyrimidine-4-carboxamide
CID 109314895
N-(2-cyanophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide
CID 109290955
N-(3-chloro-4-methylphenyl)-5-(2,6-difluoroanilino)pyrazine-2-carboxamide
CID 109293155
5-(3,5-dimethylanilino)-N-(2,5-dimethylphenyl)pyrazine-2-carboxamide
CID 109290834
5-(3,4-dimethylanilino)-N-(2,5-dimethylphenyl)pyrazine-2-carboxamide
CID 109290833
5-(2-fluoroanilino)-N-(4-methylphenyl)pyrazine-2-carboxamide
CID 109290035
6-(2,6-difluoroanilino)-N-(2,5-dimethylphenyl)pyrimidine-4-carboxamide
CID 109356913
5-(2,6-difluoroanilino)-N-(2-ethyl-6-methylphenyl)pyrazine-2-carboxamide
CID 109291880
5-(2,4-difluoroanilino)-N-(2,4,6-trimethylphenyl)pyrazine-2-carboxamide
CID 109292112
5-(2,3,4-trifluoroanilino)-N-(2,4,6-trimethylphenyl)pyrazine-2-carboxamide
CID 109292117

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide?
The IUPAC name of N-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide (CID 109290960) is N-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide?
The canonical SMILES for N-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide is Cc1ccc(C)c(Nc2cnc(C(=O)Nc3c(F)cccc3F)cn2)c1.
What is the InChIKey of N-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide?
The InChIKey is ZYRVTQNETXRCHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N4O/c1-11-6-7-12(2)15(8-11)24-17-10-22-16(9-23-17)19(26)25-18-13(20)4-3-5-14(18)21/h3-10H,1-2H3,(H,23,24)(H,25,26).
What are the key properties of N-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide?
N-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide has a molecular weight of 354.36 g/mol, XLogP of 4.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide is sourced from PubChem (CID 109290960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).