5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine

C14H10N4 — CID 154978848

IUPAC5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine
SMILESc1cnn2cc(-c3ccc4[nH]ccc4n3)cc2c1
InChIInChI=1S/C14H10N4/c1-2-11-8-10(9-18(11)16-6-1)12-3-4-13-14(17-12)5-7-15-13/h1-9,15H
InChIKeyBDINDKJVTKFURV-UHFFFAOYSA-N
MW234.26 g/mol
LogP2.88
Rot. Bonds1

About 5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine

5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine (PubChem CID 154978848) has the molecular formula C14H10N4 and a molecular weight of 234.26 g/mol. Its IUPAC name is 5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine
PubChem CID154978848
Molecular FormulaC14H10N4
Molecular Weight234.26 g/mol
Exact Mass234.09
IUPAC Name5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine
SMILESc1cnn2cc(-c3ccc4[nH]ccc4n3)cc2c1
InChIInChI=1S/C14H10N4/c1-2-11-8-10(9-18(11)16-6-1)12-3-4-13-14(17-12)5-7-15-13/h1-9,15H
InChIKeyBDINDKJVTKFURV-UHFFFAOYSA-N
XLogP2.88
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine?
The IUPAC name of 5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine (CID 154978848) is 5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine?
The canonical SMILES for 5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine is c1cnn2cc(-c3ccc4[nH]ccc4n3)cc2c1.
What is the InChIKey of 5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine?
The InChIKey is BDINDKJVTKFURV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4/c1-2-11-8-10(9-18(11)16-6-1)12-3-4-13-14(17-12)5-7-15-13/h1-9,15H.
What are the key properties of 5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine?
5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine has a molecular weight of 234.26 g/mol, XLogP of 2.88, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrrolo[1,2-b]pyridazin-6-yl-1H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 154978848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).