6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C16H12N6O — CID 162507407

IUPAC6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESNc1nc2ccc(-c3cnc(Oc4ccccc4)nc3)cn2n1
InChIInChI=1S/C16H12N6O/c17-15-20-14-7-6-11(10-22(14)21-15)12-8-18-16(19-9-12)23-13-4-2-1-3-5-13/h1-10H,(H2,17,21)
InChIKeySGNCLYFVOUWBEG-UHFFFAOYSA-N
MW304.31 g/mol
LogP2.56
Rot. Bonds3

About 6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 162507407) has the molecular formula C16H12N6O and a molecular weight of 304.31 g/mol. Its IUPAC name is 6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID162507407
Molecular FormulaC16H12N6O
Molecular Weight304.31 g/mol
Exact Mass304.11
IUPAC Name6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESNc1nc2ccc(-c3cnc(Oc4ccccc4)nc3)cn2n1
InChIInChI=1S/C16H12N6O/c17-15-20-14-7-6-11(10-22(14)21-15)12-8-18-16(19-9-12)23-13-4-2-1-3-5-13/h1-10H,(H2,17,21)
InChIKeySGNCLYFVOUWBEG-UHFFFAOYSA-N
XLogP2.56
TPSA91.22 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 162507407) is 6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is Nc1nc2ccc(-c3cnc(Oc4ccccc4)nc3)cn2n1.
What is the InChIKey of 6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is SGNCLYFVOUWBEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N6O/c17-15-20-14-7-6-11(10-22(14)21-15)12-8-18-16(19-9-12)23-13-4-2-1-3-5-13/h1-10H,(H2,17,21).
What are the key properties of 6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 304.31 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 162507407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).