8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane

C24H26N8 — CID 72714387

IUPAC8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane
SMILESCc1cncc(-c2cc3c(cn2)cnn3-c2cccc(N3CCC4(CCCN4)CC3)n2)n1
InChIInChI=1S/C24H26N8/c1-17-13-25-16-20(29-17)19-12-21-18(14-26-19)15-28-32(21)23-5-2-4-22(30-23)31-10-7-24(8-11-31)6-3-9-27-24/h2,4-5,12-16,27H,3,6-11H2,1H3
InChIKeyJOPRUVPDUTVSLP-UHFFFAOYSA-N
MW426.53 g/mol
LogP3.30
Rot. Bonds3

About 8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane

8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane (PubChem CID 72714387) has the molecular formula C24H26N8 and a molecular weight of 426.53 g/mol. Its IUPAC name is 8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane
PubChem CID72714387
Molecular FormulaC24H26N8
Molecular Weight426.53 g/mol
Exact Mass426.23
IUPAC Name8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane
SMILESCc1cncc(-c2cc3c(cn2)cnn3-c2cccc(N3CCC4(CCCN4)CC3)n2)n1
InChIInChI=1S/C24H26N8/c1-17-13-25-16-20(29-17)19-12-21-18(14-26-19)15-28-32(21)23-5-2-4-22(30-23)31-10-7-24(8-11-31)6-3-9-27-24/h2,4-5,12-16,27H,3,6-11H2,1H3
InChIKeyJOPRUVPDUTVSLP-UHFFFAOYSA-N
XLogP3.30
TPSA84.65 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.53
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane?
The IUPAC name of 8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane (CID 72714387) is 8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane.
What is the SMILES notation for 8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane?
The canonical SMILES for 8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane is Cc1cncc(-c2cc3c(cn2)cnn3-c2cccc(N3CCC4(CCCN4)CC3)n2)n1.
What is the InChIKey of 8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane?
The InChIKey is JOPRUVPDUTVSLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N8/c1-17-13-25-16-20(29-17)19-12-21-18(14-26-19)15-28-32(21)23-5-2-4-22(30-23)31-10-7-24(8-11-31)6-3-9-27-24/h2,4-5,12-16,27H,3,6-11H2,1H3.
What are the key properties of 8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane?
8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane has a molecular weight of 426.53 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,8-diazaspiro[4.5]decane is sourced from PubChem (CID 72714387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).