(8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane

C14H19N5O2 — CID 124789984

About (8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane

(8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane (PubChem CID 124789984) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is (8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane.

Molecular Properties

• Compound Name: (8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane
• PubChem CID: 124789984
• Molecular Formula: C14H19N5O2
• Molecular Weight: 289.34 g/mol
• Exact Mass: 289.15
• IUPAC Name: (8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane
• SMILES: CO[C@@H]1CCOC2(C1)CN(c1cc(C)nc3ncnn13)C2
• InChI: InChI=1S/C14H19N5O2/c1-10-5-12(19-13(17-10)15-9-16-19)18-7-14(8-18)6-11(20-2)3-4-21-14/h5,9,11H,3-4,6-8H2,1-2H3/t11-/m1/s1
• InChIKey: KQHORRDLAPRJGT-LLVKDONJSA-N
• XLogP: 0.82
• TPSA: 64.78 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 2
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	289.34
LogP ≤ 5	0.82
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of (8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane?

The IUPAC name of (8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane (CID 124789984) is (8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane.

What is the SMILES notation for (8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane?

The canonical SMILES for (8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane is CO[C@@H]1CCOC2(C1)CN(c1cc(C)nc3ncnn13)C2.

What is the InChIKey of (8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane?

The InChIKey is KQHORRDLAPRJGT-LLVKDONJSA-N. The full InChI is InChI=1S/C14H19N5O2/c1-10-5-12(19-13(17-10)15-9-16-19)18-7-14(8-18)6-11(20-2)3-4-21-14/h5,9,11H,3-4,6-8H2,1-2H3/t11-/m1/s1.

What are the key properties of (8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane?

(8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane has a molecular weight of 289.34 g/mol, XLogP of 0.82, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for (8R)-8-methoxy-2-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-5-oxa-2-azaspiro[3.5]nonane is sourced from PubChem (CID 124789984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).