3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine

C12H8N6 — CID 134398330

IUPAC3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine
SMILESc1cc2c(-c3ccnn4cncc34)cnn2cn1
InChIInChI=1S/C12H8N6/c1-4-15-18-8-14-6-12(18)9(1)10-5-16-17-7-13-3-2-11(10)17/h1-8H
InChIKeyBQGMXOJKVZDYAE-UHFFFAOYSA-N
MW236.24 g/mol
LogP1.44
Rot. Bonds1

About 3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine

3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine (PubChem CID 134398330) has the molecular formula C12H8N6 and a molecular weight of 236.24 g/mol. Its IUPAC name is 3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine.

Molecular Properties

Compound Name3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine
PubChem CID134398330
Molecular FormulaC12H8N6
Molecular Weight236.24 g/mol
Exact Mass236.08
IUPAC Name3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine
SMILESc1cc2c(-c3ccnn4cncc34)cnn2cn1
InChIInChI=1S/C12H8N6/c1-4-15-18-8-14-6-12(18)9(1)10-5-16-17-7-13-3-2-11(10)17/h1-8H
InChIKeyBQGMXOJKVZDYAE-UHFFFAOYSA-N
XLogP1.44
TPSA60.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.24
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine?
The IUPAC name of 3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine (CID 134398330) is 3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine.
What is the SMILES notation for 3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine?
The canonical SMILES for 3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine is c1cc2c(-c3ccnn4cncc34)cnn2cn1.
What is the InChIKey of 3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine?
The InChIKey is BQGMXOJKVZDYAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N6/c1-4-15-18-8-14-6-12(18)9(1)10-5-16-17-7-13-3-2-11(10)17/h1-8H.
What are the key properties of 3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine?
3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine has a molecular weight of 236.24 g/mol, XLogP of 1.44, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazo[1,5-b]pyridazin-4-ylpyrazolo[1,5-c]pyrimidine is sourced from PubChem (CID 134398330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).