N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide

C17H11Cl2FN4O — CID 109294372

IUPACN-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1cnc(Nc2cccc(F)c2)cn1
InChIInChI=1S/C17H11Cl2FN4O/c18-10-4-11(19)6-14(5-10)24-17(25)15-8-22-16(9-21-15)23-13-3-1-2-12(20)7-13/h1-9H,(H,22,23)(H,24,25)
InChIKeyZUDIGGGNJFEZJT-UHFFFAOYSA-N
MW377.21 g/mol
LogP4.92
Rot. Bonds4

About N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide

N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide (PubChem CID 109294372) has the molecular formula C17H11Cl2FN4O and a molecular weight of 377.21 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide
PubChem CID109294372
Molecular FormulaC17H11Cl2FN4O
Molecular Weight377.21 g/mol
Exact Mass376.03
IUPAC NameN-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1cnc(Nc2cccc(F)c2)cn1
InChIInChI=1S/C17H11Cl2FN4O/c18-10-4-11(19)6-14(5-10)24-17(25)15-8-22-16(9-21-15)23-13-3-1-2-12(20)7-13/h1-9H,(H,22,23)(H,24,25)
InChIKeyZUDIGGGNJFEZJT-UHFFFAOYSA-N
XLogP4.92
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.21
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide
CID 109292634
N-(4-bromophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide
CID 109293359
N-(3-chlorophenyl)-5-(4-fluoroanilino)pyrazine-2-carboxamide
CID 109292535
5-(3-chloro-4-methylanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109293178
N-[(4-chlorophenyl)methyl]-5-(3-fluoroanilino)pyrazine-2-carboxamide
CID 109282066
5-(2-fluoroanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109292440
N-(2,3-dimethylphenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide
CID 109291387
N-(4-acetamidophenyl)-5-(3-chloroanilino)pyrazine-2-carboxamide
CID 109292791
5-(2-bromoanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109294334
5-(3-chloroanilino)-N-(2,6-dichlorophenyl)pyrazine-2-carboxamide
CID 109292809
N-(3-chlorophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide
CID 109292721
N-(4-chlorophenyl)-5-[3-(trifluoromethyl)anilino]pyrazine-2-carboxamide
CID 109292840

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide?
The IUPAC name of N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide (CID 109294372) is N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide is O=C(Nc1cc(Cl)cc(Cl)c1)c1cnc(Nc2cccc(F)c2)cn1.
What is the InChIKey of N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide?
The InChIKey is ZUDIGGGNJFEZJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11Cl2FN4O/c18-10-4-11(19)6-14(5-10)24-17(25)15-8-22-16(9-21-15)23-13-3-1-2-12(20)7-13/h1-9H,(H,22,23)(H,24,25).
What are the key properties of N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide?
N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide has a molecular weight of 377.21 g/mol, XLogP of 4.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide is sourced from PubChem (CID 109294372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).