3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine

C10H8N6 — CID 121412641

IUPAC3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine
SMILESNc1nccc2nnc(-c3cccnc3)n12
InChIInChI=1S/C10H8N6/c11-10-13-5-3-8-14-15-9(16(8)10)7-2-1-4-12-6-7/h1-6H,(H2,11,13)
InChIKeyHAFXDFQWBYBJIN-UHFFFAOYSA-N
MW212.22 g/mol
LogP0.77
Rot. Bonds1

About 3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine

3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine (PubChem CID 121412641) has the molecular formula C10H8N6 and a molecular weight of 212.22 g/mol. Its IUPAC name is 3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine.

Molecular Properties

Compound Name3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine
PubChem CID121412641
Molecular FormulaC10H8N6
Molecular Weight212.22 g/mol
Exact Mass212.08
IUPAC Name3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine
SMILESNc1nccc2nnc(-c3cccnc3)n12
InChIInChI=1S/C10H8N6/c11-10-13-5-3-8-14-15-9(16(8)10)7-2-1-4-12-6-7/h1-6H,(H2,11,13)
InChIKeyHAFXDFQWBYBJIN-UHFFFAOYSA-N
XLogP0.77
TPSA81.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.22
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-pyridin-4-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine
CID 121412556
(3-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine
CID 117140840
5-methyl-3-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 68716289
3,5-dipyridin-3-yl-1,2,4-triazol-4-amine
CID 2768013
3-(4-methylpyrimidin-5-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine
CID 121412465
7-(2,2-dimethylmorpholin-4-yl)-3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine
CID 121412589
(3-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine
CID 117138334
4-(7-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)quinoline
CID 53393073
3-methyl-2-pyridin-3-ylaniline
CID 22482419
2-pyridin-3-ylpyridine-3,4-diamine
CID 118914760
3-pyridin-3-ylimidazo[1,5-a]pyridin-7-amine
CID 117144410
3-(5-ethyl-4-methyl-1,2,4-triazol-3-yl)pyridine
CID 18726700

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine?
The IUPAC name of 3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine (CID 121412641) is 3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine.
What is the SMILES notation for 3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine?
The canonical SMILES for 3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine is Nc1nccc2nnc(-c3cccnc3)n12.
What is the InChIKey of 3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine?
The InChIKey is HAFXDFQWBYBJIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N6/c11-10-13-5-3-8-14-15-9(16(8)10)7-2-1-4-12-6-7/h1-6H,(H2,11,13).
What are the key properties of 3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine?
3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine has a molecular weight of 212.22 g/mol, XLogP of 0.77, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine is sourced from PubChem (CID 121412641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).