chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile

C24H24Cl2N8O — CID 155267096

About chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile

chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 155267096) has the molecular formula C24H24Cl2N8O and a molecular weight of 511.42 g/mol. Its IUPAC name is chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

• Compound Name: chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
• PubChem CID: 155267096
• Molecular Formula: C24H24Cl2N8O
• Molecular Weight: 511.42 g/mol
• Exact Mass: 510.15
• IUPAC Name: chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
• SMILES: ClOCl.Cn1cc(-c2cc(-c3ccc(N4CCC5(CCN5)CC4)nc3)c3c(C#N)cnn3c2)cn1
• InChI: InChI=1S/C24H24N8.Cl2O/c1-30-15-20(14-28-30)18-10-21(23-19(11-25)13-29-32(23)16-18)17-2-3-22(26-12-17)31-8-5-24(6-9-31)4-7-27-24;1-3-2/h2-3,10,12-16,27H,4-9H2,1H3
• InChIKey: OFJFOYGQXJIJBB-UHFFFAOYSA-N
• XLogP: 4.31
• TPSA: 96.30 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 9
• Rotatable Bonds: 3
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	511.42
LogP ≤ 5	4.31
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?

The IUPAC name of chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 155267096) is chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile.

What is the SMILES notation for chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?

The canonical SMILES for chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile is ClOCl.Cn1cc(-c2cc(-c3ccc(N4CCC5(CCN5)CC4)nc3)c3c(C#N)cnn3c2)cn1.

What is the InChIKey of chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?

The InChIKey is OFJFOYGQXJIJBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N8.Cl2O/c1-30-15-20(14-28-30)18-10-21(23-19(11-25)13-29-32(23)16-18)17-2-3-22(26-12-17)31-8-5-24(6-9-31)4-7-27-24;1-3-2/h2-3,10,12-16,27H,4-9H2,1H3;.

What are the key properties of chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?

chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 511.42 g/mol, XLogP of 4.31, 3 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for chloro hypochlorite;4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 155267096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).