7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine

C9H9N7 — CID 69177874

IUPAC7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine
SMILESNc1nn2ccnc2c(N)c1-c1ccn[nH]1
InChIInChI=1S/C9H9N7/c10-7-6(5-1-2-13-14-5)8(11)15-16-4-3-12-9(7)16/h1-4H,10H2,(H2,11,15)(H,13,14)
InChIKeyAQALAHSKHULXJN-UHFFFAOYSA-N
MW215.22 g/mol
LogP0.28
Rot. Bonds1

About 7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine

7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine (PubChem CID 69177874) has the molecular formula C9H9N7 and a molecular weight of 215.22 g/mol. Its IUPAC name is 7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine.

Molecular Properties

Compound Name7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine
PubChem CID69177874
Molecular FormulaC9H9N7
Molecular Weight215.22 g/mol
Exact Mass215.09
IUPAC Name7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine
SMILESNc1nn2ccnc2c(N)c1-c1ccn[nH]1
InChIInChI=1S/C9H9N7/c10-7-6(5-1-2-13-14-5)8(11)15-16-4-3-12-9(7)16/h1-4H,10H2,(H2,11,15)(H,13,14)
InChIKeyAQALAHSKHULXJN-UHFFFAOYSA-N
XLogP0.28
TPSA110.91 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.22
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine?
The IUPAC name of 7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine (CID 69177874) is 7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine.
What is the SMILES notation for 7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine?
The canonical SMILES for 7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine is Nc1nn2ccnc2c(N)c1-c1ccn[nH]1.
What is the InChIKey of 7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine?
The InChIKey is AQALAHSKHULXJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N7/c10-7-6(5-1-2-13-14-5)8(11)15-16-4-3-12-9(7)16/h1-4H,10H2,(H2,11,15)(H,13,14).
What are the key properties of 7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine?
7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine has a molecular weight of 215.22 g/mol, XLogP of 0.28, 1 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazine-6,8-diamine is sourced from PubChem (CID 69177874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).