4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile

C25H26N8 — CID 126740176

IUPAC4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESCn1cc(-c2cc(-c3ccc(N4CCC5(CCNCC5)C4)nc3)c3c(C#N)cnn3c2)cn1
InChIInChI=1S/C25H26N8/c1-31-15-21(14-29-31)19-10-22(24-20(11-26)13-30-33(24)16-19)18-2-3-23(28-12-18)32-9-6-25(17-32)4-7-27-8-5-25/h2-3,10,12-16,27H,4-9,17H2,1H3
InChIKeyJJQRREWYWWGJGW-UHFFFAOYSA-N
MW438.54 g/mol
LogP3.25
Rot. Bonds3

About 4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile

4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 126740176) has the molecular formula C25H26N8 and a molecular weight of 438.54 g/mol. Its IUPAC name is 4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
PubChem CID126740176
Molecular FormulaC25H26N8
Molecular Weight438.54 g/mol
Exact Mass438.23
IUPAC Name4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESCn1cc(-c2cc(-c3ccc(N4CCC5(CCNCC5)C4)nc3)c3c(C#N)cnn3c2)cn1
InChIInChI=1S/C25H26N8/c1-31-15-21(14-29-31)19-10-22(24-20(11-26)13-30-33(24)16-19)18-2-3-23(28-12-18)32-9-6-25(17-32)4-7-27-8-5-25/h2-3,10,12-16,27H,4-9,17H2,1H3
InChIKeyJJQRREWYWWGJGW-UHFFFAOYSA-N
XLogP3.25
TPSA87.07 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.54
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?
The IUPAC name of 4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 126740176) is 4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile.
What is the SMILES notation for 4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?
The canonical SMILES for 4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile is Cn1cc(-c2cc(-c3ccc(N4CCC5(CCNCC5)C4)nc3)c3c(C#N)cnn3c2)cn1.
What is the InChIKey of 4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?
The InChIKey is JJQRREWYWWGJGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N8/c1-31-15-21(14-29-31)19-10-22(24-20(11-26)13-30-33(24)16-19)18-2-3-23(28-12-18)32-9-6-25(17-32)4-7-27-8-5-25/h2-3,10,12-16,27H,4-9,17H2,1H3.
What are the key properties of 4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?
4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 438.54 g/mol, XLogP of 3.25, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(2,8-diazaspiro[4.5]decan-2-yl)-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 126740176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).