6-propan-2-ylpyrazolo[1,5-a]pyrazine

C9H11N3 — CID 155249781

IUPAC6-propan-2-ylpyrazolo[1,5-a]pyrazine
SMILESCC(C)c1cn2nccc2cn1
InChIInChI=1S/C9H11N3/c1-7(2)9-6-12-8(5-10-9)3-4-11-12/h3-7H,1-2H3
InChIKeyFPFOTKAYIHKKDN-UHFFFAOYSA-N
MW161.21 g/mol
LogP1.85
Rot. Bonds1

About 6-propan-2-ylpyrazolo[1,5-a]pyrazine

6-propan-2-ylpyrazolo[1,5-a]pyrazine (PubChem CID 155249781) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is 6-propan-2-ylpyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name6-propan-2-ylpyrazolo[1,5-a]pyrazine
PubChem CID155249781
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC Name6-propan-2-ylpyrazolo[1,5-a]pyrazine
SMILESCC(C)c1cn2nccc2cn1
InChIInChI=1S/C9H11N3/c1-7(2)9-6-12-8(5-10-9)3-4-11-12/h3-7H,1-2H3
InChIKeyFPFOTKAYIHKKDN-UHFFFAOYSA-N
XLogP1.85
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-propan-2-ylpyrazolo[1,5-a]pyrazine?
The IUPAC name of 6-propan-2-ylpyrazolo[1,5-a]pyrazine (CID 155249781) is 6-propan-2-ylpyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 6-propan-2-ylpyrazolo[1,5-a]pyrazine?
The canonical SMILES for 6-propan-2-ylpyrazolo[1,5-a]pyrazine is CC(C)c1cn2nccc2cn1.
What is the InChIKey of 6-propan-2-ylpyrazolo[1,5-a]pyrazine?
The InChIKey is FPFOTKAYIHKKDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3/c1-7(2)9-6-12-8(5-10-9)3-4-11-12/h3-7H,1-2H3.
What are the key properties of 6-propan-2-ylpyrazolo[1,5-a]pyrazine?
6-propan-2-ylpyrazolo[1,5-a]pyrazine has a molecular weight of 161.21 g/mol, XLogP of 1.85, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-ylpyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 155249781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).