5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide

C19H17FN4O3 — CID 109293907

IUPAC5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide
SMILESCOc1ccc(OC)c(Nc2cnc(C(=O)Nc3cccc(F)c3)cn2)c1
InChIInChI=1S/C19H17FN4O3/c1-26-14-6-7-17(27-2)15(9-14)24-18-11-21-16(10-22-18)19(25)23-13-5-3-4-12(20)8-13/h3-11H,1-2H3,(H,22,24)(H,23,25)
InChIKeyWXWHVUXBSNPPFL-UHFFFAOYSA-N
MW368.37 g/mol
LogP3.63
Rot. Bonds6

About 5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide

5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide (PubChem CID 109293907) has the molecular formula C19H17FN4O3 and a molecular weight of 368.37 g/mol. Its IUPAC name is 5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide
PubChem CID109293907
Molecular FormulaC19H17FN4O3
Molecular Weight368.37 g/mol
Exact Mass368.13
IUPAC Name5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide
SMILESCOc1ccc(OC)c(Nc2cnc(C(=O)Nc3cccc(F)c3)cn2)c1
InChIInChI=1S/C19H17FN4O3/c1-26-14-6-7-17(27-2)15(9-14)24-18-11-21-16(10-22-18)19(25)23-13-5-3-4-12(20)8-13/h3-11H,1-2H3,(H,22,24)(H,23,25)
InChIKeyWXWHVUXBSNPPFL-UHFFFAOYSA-N
XLogP3.63
TPSA85.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.37
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide
CID 109293921
5-(2,4-difluoroanilino)-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide
CID 109293895
5-(2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)pyrazine-2-carboxamide
CID 109291247
5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide
CID 109289572
2-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrimidine-5-carboxamide
CID 109269933
N-(3-chloro-2-methylphenyl)-5-(2,5-dimethoxyanilino)pyrazine-2-carboxamide
CID 109292936
5-(2-fluoroanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109292440
5-(5-chloro-2-methoxyanilino)-N-phenylpyrazine-2-carboxamide
CID 109289456
5-(2,5-dimethoxyanilino)-N-(2,4-dimethylphenyl)pyrazine-2-carboxamide
CID 109290731
5-(2-bromoanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109294334
5-(3-fluoroanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109199794
N-(3-fluorophenyl)-6-(2-methoxyanilino)pyrimidine-4-carboxamide
CID 109358715

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide (CID 109293907) is 5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide is COc1ccc(OC)c(Nc2cnc(C(=O)Nc3cccc(F)c3)cn2)c1.
What is the InChIKey of 5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide?
The InChIKey is WXWHVUXBSNPPFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN4O3/c1-26-14-6-7-17(27-2)15(9-14)24-18-11-21-16(10-22-18)19(25)23-13-5-3-4-12(20)8-13/h3-11H,1-2H3,(H,22,24)(H,23,25).
What are the key properties of 5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide?
5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide has a molecular weight of 368.37 g/mol, XLogP of 3.63, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109293907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).