N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide

C11H9BrN4O2 — CID 83170144

IUPACN-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide
SMILESCc1cc(Br)cnc1NC(=O)c1c[nH]c(=O)cn1
InChIInChI=1S/C11H9BrN4O2/c1-6-2-7(12)3-15-10(6)16-11(18)8-4-14-9(17)5-13-8/h2-5H,1H3,(H,14,17)(H,15,16,18)
InChIKeyUMGOKUKWCRMKAO-UHFFFAOYSA-N
MW309.12 g/mol
LogP1.49
Rot. Bonds2

About N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide

N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide (PubChem CID 83170144) has the molecular formula C11H9BrN4O2 and a molecular weight of 309.12 g/mol. Its IUPAC name is N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide
PubChem CID83170144
Molecular FormulaC11H9BrN4O2
Molecular Weight309.12 g/mol
Exact Mass307.99
IUPAC NameN-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide
SMILESCc1cc(Br)cnc1NC(=O)c1c[nH]c(=O)cn1
InChIInChI=1S/C11H9BrN4O2/c1-6-2-7(12)3-15-10(6)16-11(18)8-4-14-9(17)5-13-8/h2-5H,1H3,(H,14,17)(H,15,16,18)
InChIKeyUMGOKUKWCRMKAO-UHFFFAOYSA-N
XLogP1.49
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.12
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-bromo-3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 115739184
5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-hydrazinylpyridine-3-carboxamide
CID 83170019
N-(5-bromo-3-methyl-2-pyridinyl)-3,6-dimethylpyridazine-4-carboxamide
CID 104670589
N-(4-bromo-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide
CID 102674338
N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-4-methylbenzamide
CID 106509648
N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide
CID 81489265
N-(5-bromo-3-methyl-2-pyridinyl)-4-chloropyridine-3-carboxamide
CID 83166694
5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-(ethylamino)pyridine-3-carboxamide
CID 83169522
5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-hydroxybenzamide
CID 113266660
N-(5-bromo-3-methyl-2-pyridinyl)-4-chloro-1-propan-2-ylpyrrole-2-carboxamide
CID 83171095
1-(5-bromo-3-methyl-2-pyridinyl)-3-propan-2-ylurea
CID 83170861
N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
CID 83170176

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide?
The IUPAC name of N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide (CID 83170144) is N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide.
What is the SMILES notation for N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide?
The canonical SMILES for N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide is Cc1cc(Br)cnc1NC(=O)c1c[nH]c(=O)cn1.
What is the InChIKey of N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide?
The InChIKey is UMGOKUKWCRMKAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrN4O2/c1-6-2-7(12)3-15-10(6)16-11(18)8-4-14-9(17)5-13-8/h2-5H,1H3,(H,14,17)(H,15,16,18).
What are the key properties of N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide?
N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide has a molecular weight of 309.12 g/mol, XLogP of 1.49, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide is sourced from PubChem (CID 83170144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).