3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid

C11H7BrN4O3 — CID 63262373

IUPAC3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid
SMILESO=C(Nc1nccnc1C(=O)O)c1ccc(Br)cn1
InChIInChI=1S/C11H7BrN4O3/c12-6-1-2-7(15-5-6)10(17)16-9-8(11(18)19)13-3-4-14-9/h1-5H,(H,18,19)(H,14,16,17)
InChIKeyUIZYXWCIQHPPIR-UHFFFAOYSA-N
MW323.11 g/mol
LogP1.58
Rot. Bonds3

About 3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid

3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid (PubChem CID 63262373) has the molecular formula C11H7BrN4O3 and a molecular weight of 323.11 g/mol. Its IUPAC name is 3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid.

Molecular Properties

Compound Name3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid
PubChem CID63262373
Molecular FormulaC11H7BrN4O3
Molecular Weight323.11 g/mol
Exact Mass321.97
IUPAC Name3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid
SMILESO=C(Nc1nccnc1C(=O)O)c1ccc(Br)cn1
InChIInChI=1S/C11H7BrN4O3/c12-6-1-2-7(15-5-6)10(17)16-9-8(11(18)19)13-3-4-14-9/h1-5H,(H,18,19)(H,14,16,17)
InChIKeyUIZYXWCIQHPPIR-UHFFFAOYSA-N
XLogP1.58
TPSA105.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.11
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(3-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid
CID 107517103
5-bromo-N-pyrimidin-2-ylpyridine-2-carboxamide
CID 62952846
3-[(3-bromo-4-fluorobenzoyl)amino]pyrazine-2-carboxylic acid
CID 107949162
3-[(1-methyl-6-oxopyridazine-3-carbonyl)amino]pyrazine-2-carboxylic acid
CID 63262070
3-[(3-bromothiophene-2-carbonyl)amino]pyrazine-2-carboxylic acid
CID 63802580
6-[(5-bromopyridine-2-carbonyl)amino]pyridine-3-carboxylic acid
CID 62958252
3-[(3-bromo-5-fluorobenzoyl)amino]pyrazine-2-carboxylic acid
CID 63262243
5-bromopyridine-2-carboxylic acid;hydrazine
CID 161359916
3-acetamidopyrazine-2-carboxylic acid
CID 10511603
5-bromo-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide
CID 55209020
5-[(5-bromopyridine-2-carbonyl)amino]thiophene-2-carboxylic acid
CID 55153618
2-[(5-bromopyridine-2-carbonyl)amino]-3,6-dichlorobenzoic acid
CID 107048547

Frequently Asked Questions

What is the IUPAC name of 3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid?
The IUPAC name of 3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid (CID 63262373) is 3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid.
What is the SMILES notation for 3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid?
The canonical SMILES for 3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid is O=C(Nc1nccnc1C(=O)O)c1ccc(Br)cn1.
What is the InChIKey of 3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid?
The InChIKey is UIZYXWCIQHPPIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrN4O3/c12-6-1-2-7(15-5-6)10(17)16-9-8(11(18)19)13-3-4-14-9/h1-5H,(H,18,19)(H,14,16,17).
What are the key properties of 3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid?
3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid has a molecular weight of 323.11 g/mol, XLogP of 1.58, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-bromopyridine-2-carbonyl)amino]pyrazine-2-carboxylic acid is sourced from PubChem (CID 63262373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).