N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide

C13H12Br2N4O — CID 107375297

IUPACN-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide
SMILESCCNc1cnc(C(=O)Nc2ccc(Br)cc2Br)cn1
InChIInChI=1S/C13H12Br2N4O/c1-2-16-12-7-17-11(6-18-12)13(20)19-10-4-3-8(14)5-9(10)15/h3-7H,2H2,1H3,(H,16,18)(H,19,20)
InChIKeyYVGBQKSYINVXDD-UHFFFAOYSA-N
MW400.07 g/mol
LogP3.69
Rot. Bonds4

About N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide

N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide (PubChem CID 107375297) has the molecular formula C13H12Br2N4O and a molecular weight of 400.07 g/mol. Its IUPAC name is N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide
PubChem CID107375297
Molecular FormulaC13H12Br2N4O
Molecular Weight400.07 g/mol
Exact Mass397.94
IUPAC NameN-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide
SMILESCCNc1cnc(C(=O)Nc2ccc(Br)cc2Br)cn1
InChIInChI=1S/C13H12Br2N4O/c1-2-16-12-7-17-11(6-18-12)13(20)19-10-4-3-8(14)5-9(10)15/h3-7H,2H2,1H3,(H,16,18)(H,19,20)
InChIKeyYVGBQKSYINVXDD-UHFFFAOYSA-N
XLogP3.69
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.07
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromo-4-chlorophenyl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107376370
5-chloro-N-(2,4-dibromophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 114923151
N-(2-chlorophenyl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107374242
N-(4-bromo-2-methylphenyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107373971
5-(ethylamino)-N-(4-iodophenyl)pyrazine-2-carboxamide
CID 107374377
N-(2-bromo-4-fluorophenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104640072
N-(2-cyano-4-fluorophenyl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107376511
N-(2,4-dibromophenyl)-4-(ethylamino)benzamide
CID 62177629
5-(ethylamino)-N-(2-methyl-4-pyridinyl)pyrazine-2-carboxamide
CID 107376119
N-(1,3-dimethylpyrazol-4-yl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107377186
N-(4-bromo-2-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide
CID 62186794
5-(ethylamino)-N-(6-oxo-1H-pyridazin-3-yl)pyrazine-2-carboxamide
CID 107377055

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide (CID 107375297) is N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide is CCNc1cnc(C(=O)Nc2ccc(Br)cc2Br)cn1.
What is the InChIKey of N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide?
The InChIKey is YVGBQKSYINVXDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12Br2N4O/c1-2-16-12-7-17-11(6-18-12)13(20)19-10-4-3-8(14)5-9(10)15/h3-7H,2H2,1H3,(H,16,18)(H,19,20).
What are the key properties of N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide?
N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide has a molecular weight of 400.07 g/mol, XLogP of 3.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dibromophenyl)-5-(ethylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 107375297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).