5-morpholin-2-ylpyrazine-2-carboxylic acid

C9H11N3O3 — CID 67151543

IUPAC5-morpholin-2-ylpyrazine-2-carboxylic acid
SMILESO=C(O)c1cnc(C2CNCCO2)cn1
InChIInChI=1S/C9H11N3O3/c13-9(14)7-4-11-6(3-12-7)8-5-10-1-2-15-8/h3-4,8,10H,1-2,5H2,(H,13,14)
InChIKeyCYQKLUZYWDLGBH-UHFFFAOYSA-N
MW209.20 g/mol
LogP-0.16
Rot. Bonds2

About 5-morpholin-2-ylpyrazine-2-carboxylic acid

5-morpholin-2-ylpyrazine-2-carboxylic acid (PubChem CID 67151543) has the molecular formula C9H11N3O3 and a molecular weight of 209.20 g/mol. Its IUPAC name is 5-morpholin-2-ylpyrazine-2-carboxylic acid.

Molecular Properties

Compound Name5-morpholin-2-ylpyrazine-2-carboxylic acid
PubChem CID67151543
Molecular FormulaC9H11N3O3
Molecular Weight209.20 g/mol
Exact Mass209.08
IUPAC Name5-morpholin-2-ylpyrazine-2-carboxylic acid
SMILESO=C(O)c1cnc(C2CNCCO2)cn1
InChIInChI=1S/C9H11N3O3/c13-9(14)7-4-11-6(3-12-7)8-5-10-1-2-15-8/h3-4,8,10H,1-2,5H2,(H,13,14)
InChIKeyCYQKLUZYWDLGBH-UHFFFAOYSA-N
XLogP-0.16
TPSA84.34 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-morpholin-2-ylpyrazine-2-carboxylic acid?
The IUPAC name of 5-morpholin-2-ylpyrazine-2-carboxylic acid (CID 67151543) is 5-morpholin-2-ylpyrazine-2-carboxylic acid.
What is the SMILES notation for 5-morpholin-2-ylpyrazine-2-carboxylic acid?
The canonical SMILES for 5-morpholin-2-ylpyrazine-2-carboxylic acid is O=C(O)c1cnc(C2CNCCO2)cn1.
What is the InChIKey of 5-morpholin-2-ylpyrazine-2-carboxylic acid?
The InChIKey is CYQKLUZYWDLGBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O3/c13-9(14)7-4-11-6(3-12-7)8-5-10-1-2-15-8/h3-4,8,10H,1-2,5H2,(H,13,14).
What are the key properties of 5-morpholin-2-ylpyrazine-2-carboxylic acid?
5-morpholin-2-ylpyrazine-2-carboxylic acid has a molecular weight of 209.20 g/mol, XLogP of -0.16, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-2-ylpyrazine-2-carboxylic acid is sourced from PubChem (CID 67151543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).