5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide

C17H11Cl2FN4O — CID 109292522

IUPAC5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1)c1cnc(Nc2cccc(Cl)c2Cl)cn1
InChIInChI=1S/C17H11Cl2FN4O/c18-12-2-1-3-13(16(12)19)24-15-9-21-14(8-22-15)17(25)23-11-6-4-10(20)5-7-11/h1-9H,(H,22,24)(H,23,25)
InChIKeyAZFCQRAJRCYWHJ-UHFFFAOYSA-N
MW377.21 g/mol
LogP4.92
Rot. Bonds4

About 5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide

5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide (PubChem CID 109292522) has the molecular formula C17H11Cl2FN4O and a molecular weight of 377.21 g/mol. Its IUPAC name is 5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide
PubChem CID109292522
Molecular FormulaC17H11Cl2FN4O
Molecular Weight377.21 g/mol
Exact Mass376.03
IUPAC Name5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1)c1cnc(Nc2cccc(Cl)c2Cl)cn1
InChIInChI=1S/C17H11Cl2FN4O/c18-12-2-1-3-13(16(12)19)24-15-9-21-14(8-22-15)17(25)23-11-6-4-10(20)5-7-11/h1-9H,(H,22,24)(H,23,25)
InChIKeyAZFCQRAJRCYWHJ-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-(2,3-dichlorophenyl)-5-(2,4-difluoroanilino)pyrazine-2-carboxamide
CID 109294513
N-(2,3-dichlorophenyl)-5-(2,6-difluoroanilino)pyrazine-2-carboxamide
CID 109294623
N-(3-cyanophenyl)-5-(2,3-dichloroanilino)pyrazine-2-carboxamide
CID 109294627
N-(2,3-dichlorophenyl)-5-[(4-fluorophenyl)methylamino]pyrazine-2-carboxamide
CID 109281781
N-(4-fluorophenyl)-5-(2,3,4-trifluoroanilino)pyrazine-2-carboxamide
CID 109292530
N-[6-(2,3-dichloroanilino)-3-pyridinyl]-2-fluorobenzamide
CID 113022429
5-(2-chloroanilino)-N-(3-chloro-4-fluorophenyl)pyrazine-2-carboxamide
CID 109292662
N-(3-chlorophenyl)-5-(4-fluoroanilino)pyrazine-2-carboxamide
CID 109292535
N-(3,4-dichlorophenyl)-5-(2-fluoroanilino)pyrazine-2-carboxamide
CID 109292450
5-(3-chloro-4-methylanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide
CID 109292474
N-(4-fluorophenyl)-5-(4-methylanilino)pyrazine-2-carboxamide
CID 109290130
5-(2-chloroanilino)-N-(4-ethylphenyl)pyrazine-2-carboxamide
CID 109291594

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide (CID 109292522) is 5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide is O=C(Nc1ccc(F)cc1)c1cnc(Nc2cccc(Cl)c2Cl)cn1.
What is the InChIKey of 5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide?
The InChIKey is AZFCQRAJRCYWHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11Cl2FN4O/c18-12-2-1-3-13(16(12)19)24-15-9-21-14(8-22-15)17(25)23-11-6-4-10(20)5-7-11/h1-9H,(H,22,24)(H,23,25).
What are the key properties of 5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide?
5-(2,3-dichloroanilino)-N-(4-fluorophenyl)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 5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109292522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).