4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine

C13H10N8 — CID 102627331

IUPAC4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine
SMILESNc1nc(-c2cccc3nccn23)nc(-n2cccn2)n1
InChIInChI=1S/C13H10N8/c14-12-17-11(18-13(19-12)21-7-2-5-16-21)9-3-1-4-10-15-6-8-20(9)10/h1-8H,(H2,14,17,18,19)
InChIKeyOCWGGCPSKSTUHD-UHFFFAOYSA-N
MW278.28 g/mol
LogP0.95
Rot. Bonds2

About 4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine

4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine (PubChem CID 102627331) has the molecular formula C13H10N8 and a molecular weight of 278.28 g/mol. Its IUPAC name is 4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine
PubChem CID102627331
Molecular FormulaC13H10N8
Molecular Weight278.28 g/mol
Exact Mass278.10
IUPAC Name4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine
SMILESNc1nc(-c2cccc3nccn23)nc(-n2cccn2)n1
InChIInChI=1S/C13H10N8/c14-12-17-11(18-13(19-12)21-7-2-5-16-21)9-3-1-4-10-15-6-8-20(9)10/h1-8H,(H2,14,17,18,19)
InChIKeyOCWGGCPSKSTUHD-UHFFFAOYSA-N
XLogP0.95
TPSA99.81 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.28
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine (CID 102627331) is 4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine is Nc1nc(-c2cccc3nccn23)nc(-n2cccn2)n1.
What is the InChIKey of 4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine?
The InChIKey is OCWGGCPSKSTUHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N8/c14-12-17-11(18-13(19-12)21-7-2-5-16-21)9-3-1-4-10-15-6-8-20(9)10/h1-8H,(H2,14,17,18,19).
What are the key properties of 4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine?
4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine has a molecular weight of 278.28 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazo[1,2-a]pyridin-5-yl-6-pyrazol-1-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 102627331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).