5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine

C15H12N10 — CID 53261806

IUPAC5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine
SMILESCn1cc(-c2cnc3nnn(Cc4ccc5ncnn5c4)c3n2)cn1
InChIInChI=1S/C15H12N10/c1-23-8-11(4-18-23)12-5-16-14-15(20-12)25(22-21-14)7-10-2-3-13-17-9-19-24(13)6-10/h2-6,8-9H,7H2,1H3
InChIKeyKZNUZLHBMRLQDE-UHFFFAOYSA-N
MW332.33 g/mol
LogP0.71
Rot. Bonds3

About 5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine

5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine (PubChem CID 53261806) has the molecular formula C15H12N10 and a molecular weight of 332.33 g/mol. Its IUPAC name is 5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine.

Molecular Properties

Compound Name5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine
PubChem CID53261806
Molecular FormulaC15H12N10
Molecular Weight332.33 g/mol
Exact Mass332.12
IUPAC Name5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine
SMILESCn1cc(-c2cnc3nnn(Cc4ccc5ncnn5c4)c3n2)cn1
InChIInChI=1S/C15H12N10/c1-23-8-11(4-18-23)12-5-16-14-15(20-12)25(22-21-14)7-10-2-3-13-17-9-19-24(13)6-10/h2-6,8-9H,7H2,1H3
InChIKeyKZNUZLHBMRLQDE-UHFFFAOYSA-N
XLogP0.71
TPSA104.50 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.33
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine?
The IUPAC name of 5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine (CID 53261806) is 5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine.
What is the SMILES notation for 5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine?
The canonical SMILES for 5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine is Cn1cc(-c2cnc3nnn(Cc4ccc5ncnn5c4)c3n2)cn1.
What is the InChIKey of 5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine?
The InChIKey is KZNUZLHBMRLQDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N10/c1-23-8-11(4-18-23)12-5-16-14-15(20-12)25(22-21-14)7-10-2-3-13-17-9-19-24(13)6-10/h2-6,8-9H,7H2,1H3.
What are the key properties of 5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine?
5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine has a molecular weight of 332.33 g/mol, XLogP of 0.71, 3 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpyrazol-4-yl)-3-([1,2,4]triazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine is sourced from PubChem (CID 53261806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).