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

C18H14Cl2N4O2 — CID 109293597

IUPAC5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cnc(Nc3ccc(Cl)c(Cl)c3)cn2)cc1
InChIInChI=1S/C18H14Cl2N4O2/c1-26-13-5-2-11(3-6-13)24-18(25)16-9-22-17(10-21-16)23-12-4-7-14(19)15(20)8-12/h2-10H,1H3,(H,22,23)(H,24,25)
InChIKeyAALFEAXGAAWOAL-UHFFFAOYSA-N
MW389.24 g/mol
LogP4.79
Rot. Bonds5

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

5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide (PubChem CID 109293597) has the molecular formula C18H14Cl2N4O2 and a molecular weight of 389.24 g/mol. Its IUPAC name is 5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
PubChem CID109293597
Molecular FormulaC18H14Cl2N4O2
Molecular Weight389.24 g/mol
Exact Mass388.05
IUPAC Name5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cnc(Nc3ccc(Cl)c(Cl)c3)cn2)cc1
InChIInChI=1S/C18H14Cl2N4O2/c1-26-13-5-2-11(3-6-13)24-18(25)16-9-22-17(10-21-16)23-12-4-7-14(19)15(20)8-12/h2-10H,1H3,(H,22,23)(H,24,25)
InChIKeyAALFEAXGAAWOAL-UHFFFAOYSA-N
XLogP4.79
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.24
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(3-chloro-4-methylanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 109293161
5-(3-chloro-4-methoxyanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 109293298
N-(4-acetamidophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide
CID 109293534
methyl 4-[[5-(4-methoxyanilino)pyrazine-2-carbonyl]amino]benzoate
CID 109293630
N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide
CID 109293614
5-(3-chloro-4-methoxyanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide
CID 109292477
5-hydrazinyl-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 107377590
2-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 109178053
N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide
CID 109294564
N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide
CID 109289766
5-(3-chloro-4-methoxyanilino)-N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 109199601
N-(3-chlorophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide
CID 109292721

Frequently Asked Questions

What is the IUPAC name of 5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide (CID 109293597) is 5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide is COc1ccc(NC(=O)c2cnc(Nc3ccc(Cl)c(Cl)c3)cn2)cc1.
What is the InChIKey of 5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide?
The InChIKey is AALFEAXGAAWOAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2N4O2/c1-26-13-5-2-11(3-6-13)24-18(25)16-9-22-17(10-21-16)23-12-4-7-14(19)15(20)8-12/h2-10H,1H3,(H,22,23)(H,24,25).
What are the key properties of 5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide?
5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide has a molecular weight of 389.24 g/mol, XLogP of 4.79, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109293597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).