3-cyclopentyloxypyrazine-2-carboxylic acid

C10H12N2O3 — CID 62702395

IUPAC3-cyclopentyloxypyrazine-2-carboxylic acid
SMILESO=C(O)c1nccnc1OC1CCCC1
InChIInChI=1S/C10H12N2O3/c13-10(14)8-9(12-6-5-11-8)15-7-3-1-2-4-7/h5-7H,1-4H2,(H,13,14)
InChIKeyGNQHMMVMRREMHO-UHFFFAOYSA-N
MW208.22 g/mol
LogP1.50
Rot. Bonds3

About 3-cyclopentyloxypyrazine-2-carboxylic acid

3-cyclopentyloxypyrazine-2-carboxylic acid (PubChem CID 62702395) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is 3-cyclopentyloxypyrazine-2-carboxylic acid.

Molecular Properties

Compound Name3-cyclopentyloxypyrazine-2-carboxylic acid
PubChem CID62702395
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name3-cyclopentyloxypyrazine-2-carboxylic acid
SMILESO=C(O)c1nccnc1OC1CCCC1
InChIInChI=1S/C10H12N2O3/c13-10(14)8-9(12-6-5-11-8)15-7-3-1-2-4-7/h5-7H,1-4H2,(H,13,14)
InChIKeyGNQHMMVMRREMHO-UHFFFAOYSA-N
XLogP1.50
TPSA72.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyloxypyrazine-2-carboxylic acid?
The IUPAC name of 3-cyclopentyloxypyrazine-2-carboxylic acid (CID 62702395) is 3-cyclopentyloxypyrazine-2-carboxylic acid.
What is the SMILES notation for 3-cyclopentyloxypyrazine-2-carboxylic acid?
The canonical SMILES for 3-cyclopentyloxypyrazine-2-carboxylic acid is O=C(O)c1nccnc1OC1CCCC1.
What is the InChIKey of 3-cyclopentyloxypyrazine-2-carboxylic acid?
The InChIKey is GNQHMMVMRREMHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c13-10(14)8-9(12-6-5-11-8)15-7-3-1-2-4-7/h5-7H,1-4H2,(H,13,14).
What are the key properties of 3-cyclopentyloxypyrazine-2-carboxylic acid?
3-cyclopentyloxypyrazine-2-carboxylic acid has a molecular weight of 208.22 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyloxypyrazine-2-carboxylic acid is sourced from PubChem (CID 62702395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).