3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid

C11H7ClN4O3 — CID 114035227

IUPAC3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid
SMILESO=C(Nc1cccnc1C(=O)O)c1cncc(Cl)n1
InChIInChI=1S/C11H7ClN4O3/c12-8-5-13-4-7(15-8)10(17)16-6-2-1-3-14-9(6)11(18)19/h1-5H,(H,16,17)(H,18,19)
InChIKeyJPZUQOLVNPIGAV-UHFFFAOYSA-N
MW278.66 g/mol
LogP1.48
Rot. Bonds3

About 3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid

3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid (PubChem CID 114035227) has the molecular formula C11H7ClN4O3 and a molecular weight of 278.66 g/mol. Its IUPAC name is 3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid
PubChem CID114035227
Molecular FormulaC11H7ClN4O3
Molecular Weight278.66 g/mol
Exact Mass278.02
IUPAC Name3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid
SMILESO=C(Nc1cccnc1C(=O)O)c1cncc(Cl)n1
InChIInChI=1S/C11H7ClN4O3/c12-8-5-13-4-7(15-8)10(17)16-6-2-1-3-14-9(6)11(18)19/h1-5H,(H,16,17)(H,18,19)
InChIKeyJPZUQOLVNPIGAV-UHFFFAOYSA-N
XLogP1.48
TPSA105.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.66
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-N-quinolin-8-ylpyrazine-2-carboxamide
CID 103186933
3-[(4-chloropyridine-2-carbonyl)amino]pyridine-2-carboxylic acid
CID 104740156
3-[(5-methylpyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid
CID 104740393
N-(3-bromo-4-pyridinyl)-6-chloropyrazine-2-carboxamide
CID 106551588
4-[(6-chloropyrazine-2-carbonyl)amino]-3-hydroxybenzoic acid
CID 136704058
6-chloro-N-(3-fluoro-2-methylphenyl)pyrazine-2-carboxamide
CID 103337581
3-[(3-chloro-5-methylbenzoyl)amino]pyridine-2-carboxylic acid
CID 104740205
3-(pyridin-3-ylcarbamoylamino)pyridine-2-carboxylic acid
CID 104743150
3-[(2,6-dimethylpyridine-3-carbonyl)amino]pyridine-2-carboxylic acid
CID 104740370
6-chloro-N-[2-(4-methylpiperazin-1-yl)phenyl]pyrazine-2-carboxamide
CID 57327107
3-[(2,4-dioxo-1H-pyrimidine-6-carbonyl)amino]pyridine-2-carboxylic acid
CID 104739610
6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide
CID 103337437

Frequently Asked Questions

What is the IUPAC name of 3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid?
The IUPAC name of 3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid (CID 114035227) is 3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid.
What is the SMILES notation for 3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid?
The canonical SMILES for 3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid is O=C(Nc1cccnc1C(=O)O)c1cncc(Cl)n1.
What is the InChIKey of 3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid?
The InChIKey is JPZUQOLVNPIGAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClN4O3/c12-8-5-13-4-7(15-8)10(17)16-6-2-1-3-14-9(6)11(18)19/h1-5H,(H,16,17)(H,18,19).
What are the key properties of 3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid?
3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid has a molecular weight of 278.66 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid is sourced from PubChem (CID 114035227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).