5H-pyrrolo[2,3-b]pyrazine

C6H5N3 — CID 5370803

IUPAC5H-pyrrolo[2,3-b]pyrazine
SMILESc1cnc2[nH]ccc2n1
InChIInChI=1S/C6H5N3/c1-2-8-6-5(1)7-3-4-9-6/h1-4H,(H,8,9)
InChIKeyHFTVJMFWJUFBNO-UHFFFAOYSA-N
MW119.13 g/mol
LogP0.96
Rot. Bonds

About 5H-pyrrolo[2,3-b]pyrazine

5H-pyrrolo[2,3-b]pyrazine (PubChem CID 5370803) has the molecular formula C6H5N3 and a molecular weight of 119.13 g/mol. Its IUPAC name is 5H-pyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name5H-pyrrolo[2,3-b]pyrazine
PubChem CID5370803
Molecular FormulaC6H5N3
Molecular Weight119.13 g/mol
Exact Mass119.05
IUPAC Name5H-pyrrolo[2,3-b]pyrazine
SMILESc1cnc2[nH]ccc2n1
InChIInChI=1S/C6H5N3/c1-2-8-6-5(1)7-3-4-9-6/h1-4H,(H,8,9)
InChIKeyHFTVJMFWJUFBNO-UHFFFAOYSA-N
XLogP0.96
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.13
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5H-pyrrolo[2,3-b]pyrazine?
The IUPAC name of 5H-pyrrolo[2,3-b]pyrazine (CID 5370803) is 5H-pyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 5H-pyrrolo[2,3-b]pyrazine?
The canonical SMILES for 5H-pyrrolo[2,3-b]pyrazine is c1cnc2[nH]ccc2n1.
What is the InChIKey of 5H-pyrrolo[2,3-b]pyrazine?
The InChIKey is HFTVJMFWJUFBNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3/c1-2-8-6-5(1)7-3-4-9-6/h1-4H,(H,8,9).
What are the key properties of 5H-pyrrolo[2,3-b]pyrazine?
5H-pyrrolo[2,3-b]pyrazine has a molecular weight of 119.13 g/mol, XLogP of 0.96, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5H-pyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 5370803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).