5-cyclopentylpyrazine-2-carboxylic acid

C10H12N2O2 — CID 135241231

IUPAC5-cyclopentylpyrazine-2-carboxylic acid
SMILESO=C(O)c1cnc(C2CCCC2)cn1
InChIInChI=1S/C10H12N2O2/c13-10(14)9-6-11-8(5-12-9)7-3-1-2-4-7/h5-7H,1-4H2,(H,13,14)
InChIKeyVZMRNEAGMTYKDN-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.83
Rot. Bonds2

About 5-cyclopentylpyrazine-2-carboxylic acid

5-cyclopentylpyrazine-2-carboxylic acid (PubChem CID 135241231) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 5-cyclopentylpyrazine-2-carboxylic acid.

Molecular Properties

Compound Name5-cyclopentylpyrazine-2-carboxylic acid
PubChem CID135241231
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name5-cyclopentylpyrazine-2-carboxylic acid
SMILESO=C(O)c1cnc(C2CCCC2)cn1
InChIInChI=1S/C10H12N2O2/c13-10(14)9-6-11-8(5-12-9)7-3-1-2-4-7/h5-7H,1-4H2,(H,13,14)
InChIKeyVZMRNEAGMTYKDN-UHFFFAOYSA-N
XLogP1.83
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopentylpyrazine-2-carboxylic acid?
The IUPAC name of 5-cyclopentylpyrazine-2-carboxylic acid (CID 135241231) is 5-cyclopentylpyrazine-2-carboxylic acid.
What is the SMILES notation for 5-cyclopentylpyrazine-2-carboxylic acid?
The canonical SMILES for 5-cyclopentylpyrazine-2-carboxylic acid is O=C(O)c1cnc(C2CCCC2)cn1.
What is the InChIKey of 5-cyclopentylpyrazine-2-carboxylic acid?
The InChIKey is VZMRNEAGMTYKDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c13-10(14)9-6-11-8(5-12-9)7-3-1-2-4-7/h5-7H,1-4H2,(H,13,14).
What are the key properties of 5-cyclopentylpyrazine-2-carboxylic acid?
5-cyclopentylpyrazine-2-carboxylic acid has a molecular weight of 192.22 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentylpyrazine-2-carboxylic acid is sourced from PubChem (CID 135241231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).