7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine

C14H12N8 — CID 164616306

IUPAC7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine
SMILESNc1cc(Cc2ccn(-c3ccccn3)n2)c2n[nH]nc2n1
InChIInChI=1S/C14H12N8/c15-11-8-9(13-14(17-11)19-21-18-13)7-10-4-6-22(20-10)12-3-1-2-5-16-12/h1-6,8H,7H2,(H3,15,17,18,19,21)
InChIKeyJNZFHVVQTAJYFF-UHFFFAOYSA-N
MW292.31 g/mol
LogP1.11
Rot. Bonds3

About 7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine

7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine (PubChem CID 164616306) has the molecular formula C14H12N8 and a molecular weight of 292.31 g/mol. Its IUPAC name is 7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine
PubChem CID164616306
Molecular FormulaC14H12N8
Molecular Weight292.31 g/mol
Exact Mass292.12
IUPAC Name7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine
SMILESNc1cc(Cc2ccn(-c3ccccn3)n2)c2n[nH]nc2n1
InChIInChI=1S/C14H12N8/c15-11-8-9(13-14(17-11)19-21-18-13)7-10-4-6-22(20-10)12-3-1-2-5-16-12/h1-6,8H,7H2,(H3,15,17,18,19,21)
InChIKeyJNZFHVVQTAJYFF-UHFFFAOYSA-N
XLogP1.11
TPSA111.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.31
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine?
The IUPAC name of 7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine (CID 164616306) is 7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine?
The canonical SMILES for 7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine is Nc1cc(Cc2ccn(-c3ccccn3)n2)c2n[nH]nc2n1.
What is the InChIKey of 7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine?
The InChIKey is JNZFHVVQTAJYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N8/c15-11-8-9(13-14(17-11)19-21-18-13)7-10-4-6-22(20-10)12-3-1-2-5-16-12/h1-6,8H,7H2,(H3,15,17,18,19,21).
What are the key properties of 7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine?
7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine has a molecular weight of 292.31 g/mol, XLogP of 1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(1-pyridin-2-ylpyrazol-3-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 164616306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).