N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide

C14H14Cl2N4O2 — CID 109276006

IUPACN-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide
SMILESCOCCNc1cnc(C(=O)Nc2cc(Cl)ccc2Cl)cn1
InChIInChI=1S/C14H14Cl2N4O2/c1-22-5-4-17-13-8-18-12(7-19-13)14(21)20-11-6-9(15)2-3-10(11)16/h2-3,6-8H,4-5H2,1H3,(H,17,19)(H,20,21)
InChIKeyFPLFUVSJEGQASE-UHFFFAOYSA-N
MW341.20 g/mol
LogP3.09
Rot. Bonds6

About N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide

N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide (PubChem CID 109276006) has the molecular formula C14H14Cl2N4O2 and a molecular weight of 341.20 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide
PubChem CID109276006
Molecular FormulaC14H14Cl2N4O2
Molecular Weight341.20 g/mol
Exact Mass340.05
IUPAC NameN-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide
SMILESCOCCNc1cnc(C(=O)Nc2cc(Cl)ccc2Cl)cn1
InChIInChI=1S/C14H14Cl2N4O2/c1-22-5-4-17-13-8-18-12(7-19-13)14(21)20-11-6-9(15)2-3-10(11)16/h2-3,6-8H,4-5H2,1H3,(H,17,19)(H,20,21)
InChIKeyFPLFUVSJEGQASE-UHFFFAOYSA-N
XLogP3.09
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.20
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2,5-dichlorophenyl)-5-(2-methylpropylamino)pyrazine-2-carboxamide
CID 109273098
5-(2-methoxyethylamino)-N-(2,3,4-trifluorophenyl)pyrazine-2-carboxamide
CID 109276018
5-(2-methoxyethylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
CID 109275954
N-(3-chloro-4-methoxyphenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide
CID 109275950
N-(2,5-dichlorophenyl)-5-[(3-methylphenyl)methylamino]pyrazine-2-carboxamide
CID 109280476
N-(2,5-dichlorophenyl)-6-(3-methoxypropylamino)pyridazine-3-carboxamide
CID 109114249
2,5-dichloro-N-(2-methoxyethyl)aniline
CID 28568177
N-(2,5-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide
CID 109294588
N-(2,4-dimethylphenyl)-5-(3-methoxypropylamino)pyrazine-2-carboxamide
CID 109276285
5-(2,5-dichloroanilino)-N-(2-methylphenyl)pyrazine-2-carboxamide
CID 109289712
N-(2,5-dichlorophenyl)-5-(2,4-difluoroanilino)pyrazine-2-carboxamide
CID 109294510
5-(2-chloroanilino)-N-(5-chloro-2-methylphenyl)pyrazine-2-carboxamide
CID 109292659

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide (CID 109276006) is N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide is COCCNc1cnc(C(=O)Nc2cc(Cl)ccc2Cl)cn1.
What is the InChIKey of N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide?
The InChIKey is FPLFUVSJEGQASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N4O2/c1-22-5-4-17-13-8-18-12(7-19-13)14(21)20-11-6-9(15)2-3-10(11)16/h2-3,6-8H,4-5H2,1H3,(H,17,19)(H,20,21).
What are the key properties of N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide?
N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide has a molecular weight of 341.20 g/mol, XLogP of 3.09, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-5-(2-methoxyethylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 109276006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).