5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide

C11H9BrN4O — CID 113381818

IUPAC5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide
SMILESNc1cnc(C(=O)Nc2ccc(Br)cc2)cn1
InChIInChI=1S/C11H9BrN4O/c12-7-1-3-8(4-2-7)16-11(17)9-5-15-10(13)6-14-9/h1-6H,(H2,13,15)(H,16,17)
InChIKeyIFLWSSCQHSYGGD-UHFFFAOYSA-N
MW293.12 g/mol
LogP2.07
Rot. Bonds2

About 5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide

5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide (PubChem CID 113381818) has the molecular formula C11H9BrN4O and a molecular weight of 293.12 g/mol. Its IUPAC name is 5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide
PubChem CID113381818
Molecular FormulaC11H9BrN4O
Molecular Weight293.12 g/mol
Exact Mass292.00
IUPAC Name5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide
SMILESNc1cnc(C(=O)Nc2ccc(Br)cc2)cn1
InChIInChI=1S/C11H9BrN4O/c12-7-1-3-8(4-2-7)16-11(17)9-5-15-10(13)6-14-9/h1-6H,(H2,13,15)(H,16,17)
InChIKeyIFLWSSCQHSYGGD-UHFFFAOYSA-N
XLogP2.07
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.12
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-bromophenyl)-5-hydrazinylpyrazine-2-carboxamide
CID 107377733
5-amino-N-(2,4,6-tribromophenyl)pyrazine-2-carboxamide
CID 107374395
N-(4-bromophenyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107374238
5-amino-N-(4-bromo-2-cyanophenyl)pyrazine-2-carboxamide
CID 107376526
N-(4-bromophenyl)-5-carbamothioylpyridine-2-carboxamide
CID 63724746
5-N-(4-bromophenyl)pyridine-2,5-dicarboxamide
CID 47460208
5-amino-N-(4-chloro-3-methoxyphenyl)pyrazine-2-carboxamide
CID 107623030
5-amino-N-(3-cyano-4-fluorophenyl)pyrazine-2-carboxamide
CID 107375402
5-amino-N-(2-bromo-4-fluorophenyl)pyrazine-2-carboxamide
CID 107374346
5-amino-N-(2-bromo-4,6-difluorophenyl)pyrazine-2-carboxamide
CID 107374421
5-amino-N-(2-bromo-4-methylphenyl)pyrazine-2-carboxamide
CID 107373934
5-amino-N-(2-bromo-6-fluorophenyl)pyrazine-2-carboxamide
CID 107603346

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide (CID 113381818) is 5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide is Nc1cnc(C(=O)Nc2ccc(Br)cc2)cn1.
What is the InChIKey of 5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide?
The InChIKey is IFLWSSCQHSYGGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrN4O/c12-7-1-3-8(4-2-7)16-11(17)9-5-15-10(13)6-14-9/h1-6H,(H2,13,15)(H,16,17).
What are the key properties of 5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide?
5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide has a molecular weight of 293.12 g/mol, XLogP of 2.07, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(4-bromophenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 113381818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).