2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine

C10H9N5 — CID 67513372

IUPAC2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine
SMILESCn1cc(-c2cnc3[nH]ccc3n2)cn1
InChIInChI=1S/C10H9N5/c1-15-6-7(4-13-15)9-5-12-10-8(14-9)2-3-11-10/h2-6H,1H3,(H,11,12)
InChIKeyQCROAGMDACCZIG-UHFFFAOYSA-N
MW199.22 g/mol
LogP1.36
Rot. Bonds1

About 2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine

2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine (PubChem CID 67513372) has the molecular formula C10H9N5 and a molecular weight of 199.22 g/mol. Its IUPAC name is 2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine
PubChem CID67513372
Molecular FormulaC10H9N5
Molecular Weight199.22 g/mol
Exact Mass199.09
IUPAC Name2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine
SMILESCn1cc(-c2cnc3[nH]ccc3n2)cn1
InChIInChI=1S/C10H9N5/c1-15-6-7(4-13-15)9-5-12-10-8(14-9)2-3-11-10/h2-6H,1H3,(H,11,12)
InChIKeyQCROAGMDACCZIG-UHFFFAOYSA-N
XLogP1.36
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.22
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine?
The IUPAC name of 2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine (CID 67513372) is 2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine?
The canonical SMILES for 2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine is Cn1cc(-c2cnc3[nH]ccc3n2)cn1.
What is the InChIKey of 2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine?
The InChIKey is QCROAGMDACCZIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N5/c1-15-6-7(4-13-15)9-5-12-10-8(14-9)2-3-11-10/h2-6H,1H3,(H,11,12).
What are the key properties of 2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine?
2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine has a molecular weight of 199.22 g/mol, XLogP of 1.36, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 67513372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).