6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine

C26H24N6 — CID 127034760

IUPAC6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine
SMILESCN1CCN(c2ccc3nc(-c4cccc5ccccc45)c(-c4ccncc4)n3n2)CC1
InChIInChI=1S/C26H24N6/c1-30-15-17-31(18-16-30)24-10-9-23-28-25(22-8-4-6-19-5-2-3-7-21(19)22)26(32(23)29-24)20-11-13-27-14-12-20/h2-14H,15-18H2,1H3
InChIKeyRTWXJPNBTHXJKE-UHFFFAOYSA-N
MW420.52 g/mol
LogP4.36
Rot. Bonds3

About 6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine

6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine (PubChem CID 127034760) has the molecular formula C26H24N6 and a molecular weight of 420.52 g/mol. Its IUPAC name is 6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine
PubChem CID127034760
Molecular FormulaC26H24N6
Molecular Weight420.52 g/mol
Exact Mass420.21
IUPAC Name6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine
SMILESCN1CCN(c2ccc3nc(-c4cccc5ccccc45)c(-c4ccncc4)n3n2)CC1
InChIInChI=1S/C26H24N6/c1-30-15-17-31(18-16-30)24-10-9-23-28-25(22-8-4-6-19-5-2-3-7-21(19)22)26(32(23)29-24)20-11-13-27-14-12-20/h2-14H,15-18H2,1H3
InChIKeyRTWXJPNBTHXJKE-UHFFFAOYSA-N
XLogP4.36
TPSA49.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.52
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
The IUPAC name of 6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine (CID 127034760) is 6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
The canonical SMILES for 6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine is CN1CCN(c2ccc3nc(-c4cccc5ccccc45)c(-c4ccncc4)n3n2)CC1.
What is the InChIKey of 6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
The InChIKey is RTWXJPNBTHXJKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N6/c1-30-15-17-31(18-16-30)24-10-9-23-28-25(22-8-4-6-19-5-2-3-7-21(19)22)26(32(23)29-24)20-11-13-27-14-12-20/h2-14H,15-18H2,1H3.
What are the key properties of 6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine has a molecular weight of 420.52 g/mol, XLogP of 4.36, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 127034760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).