3,6-bis(1H-pyrrol-2-yl)pyridazine

C12H10N4 — CID 102440417

IUPAC3,6-bis(1H-pyrrol-2-yl)pyridazine
SMILESc1c[nH]c(-c2ccc(-c3ccc[nH]3)nn2)c1
InChIInChI=1S/C12H10N4/c1-3-9(13-7-1)11-5-6-12(16-15-11)10-4-2-8-14-10/h1-8,13-14H
InChIKeyAOVSDMHJLCSOJY-UHFFFAOYSA-N
MW210.24 g/mol
LogP2.47
Rot. Bonds2

About 3,6-bis(1H-pyrrol-2-yl)pyridazine

3,6-bis(1H-pyrrol-2-yl)pyridazine (PubChem CID 102440417) has the molecular formula C12H10N4 and a molecular weight of 210.24 g/mol. Its IUPAC name is 3,6-bis(1H-pyrrol-2-yl)pyridazine.

Molecular Properties

Compound Name3,6-bis(1H-pyrrol-2-yl)pyridazine
PubChem CID102440417
Molecular FormulaC12H10N4
Molecular Weight210.24 g/mol
Exact Mass210.09
IUPAC Name3,6-bis(1H-pyrrol-2-yl)pyridazine
SMILESc1c[nH]c(-c2ccc(-c3ccc[nH]3)nn2)c1
InChIInChI=1S/C12H10N4/c1-3-9(13-7-1)11-5-6-12(16-15-11)10-4-2-8-14-10/h1-8,13-14H
InChIKeyAOVSDMHJLCSOJY-UHFFFAOYSA-N
XLogP2.47
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,6-bis(1H-pyrrol-2-yl)pyridazine?
The IUPAC name of 3,6-bis(1H-pyrrol-2-yl)pyridazine (CID 102440417) is 3,6-bis(1H-pyrrol-2-yl)pyridazine.
What is the SMILES notation for 3,6-bis(1H-pyrrol-2-yl)pyridazine?
The canonical SMILES for 3,6-bis(1H-pyrrol-2-yl)pyridazine is c1c[nH]c(-c2ccc(-c3ccc[nH]3)nn2)c1.
What is the InChIKey of 3,6-bis(1H-pyrrol-2-yl)pyridazine?
The InChIKey is AOVSDMHJLCSOJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4/c1-3-9(13-7-1)11-5-6-12(16-15-11)10-4-2-8-14-10/h1-8,13-14H.
What are the key properties of 3,6-bis(1H-pyrrol-2-yl)pyridazine?
3,6-bis(1H-pyrrol-2-yl)pyridazine has a molecular weight of 210.24 g/mol, XLogP of 2.47, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-bis(1H-pyrrol-2-yl)pyridazine is sourced from PubChem (CID 102440417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).