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

C9H7N5 — CID 90105293

IUPAC2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine
SMILESc1cc2nc(-c3cn[nH]c3)cnc2[nH]1
InChIInChI=1S/C9H7N5/c1-2-10-9-7(1)14-8(5-11-9)6-3-12-13-4-6/h1-5H,(H,10,11)(H,12,13)
InChIKeyLTFQPYDMHBLAGZ-UHFFFAOYSA-N
MW185.19 g/mol
LogP1.35
Rot. Bonds1

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

2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine (PubChem CID 90105293) has the molecular formula C9H7N5 and a molecular weight of 185.19 g/mol. Its IUPAC name is 2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine
PubChem CID90105293
Molecular FormulaC9H7N5
Molecular Weight185.19 g/mol
Exact Mass185.07
IUPAC Name2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine
SMILESc1cc2nc(-c3cn[nH]c3)cnc2[nH]1
InChIInChI=1S/C9H7N5/c1-2-10-9-7(1)14-8(5-11-9)6-3-12-13-4-6/h1-5H,(H,10,11)(H,12,13)
InChIKeyLTFQPYDMHBLAGZ-UHFFFAOYSA-N
XLogP1.35
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.19
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine?
The IUPAC name of 2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine (CID 90105293) is 2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine?
The canonical SMILES for 2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine is c1cc2nc(-c3cn[nH]c3)cnc2[nH]1.
What is the InChIKey of 2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine?
The InChIKey is LTFQPYDMHBLAGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N5/c1-2-10-9-7(1)14-8(5-11-9)6-3-12-13-4-6/h1-5H,(H,10,11)(H,12,13).
What are the key properties of 2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine?
2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine has a molecular weight of 185.19 g/mol, XLogP of 1.35, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 90105293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).