2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol

C14H21N5O2 — CID 78845347

About 2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol

2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol (PubChem CID 78845347) has the molecular formula C14H21N5O2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol.

Molecular Properties

• Compound Name: 2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol
• PubChem CID: 78845347
• Molecular Formula: C14H21N5O2
• Molecular Weight: 291.35 g/mol
• Exact Mass: 291.17
• IUPAC Name: 2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol
• SMILES: COCc1cc(N2CCCCC2CCO)n2ncnc2n1
• InChI: InChI=1S/C14H21N5O2/c1-21-9-11-8-13(19-14(17-11)15-10-16-19)18-6-3-2-4-12(18)5-7-20/h8,10,12,20H,2-7,9H2,1H3
• InChIKey: QGIDZGJJFDATCK-UHFFFAOYSA-N
• XLogP: 1.01
• TPSA: 75.78 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	291.35
LogP ≤ 5	1.01
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol?

The IUPAC name of 2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol (CID 78845347) is 2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol.

What is the SMILES notation for 2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol?

The canonical SMILES for 2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol is COCc1cc(N2CCCCC2CCO)n2ncnc2n1.

What is the InChIKey of 2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol?

The InChIKey is QGIDZGJJFDATCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2/c1-21-9-11-8-13(19-14(17-11)15-10-16-19)18-6-3-2-4-12(18)5-7-20/h8,10,12,20H,2-7,9H2,1H3.

What are the key properties of 2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol?

2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol has a molecular weight of 291.35 g/mol, XLogP of 1.01, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-2-yl]ethanol is sourced from PubChem (CID 78845347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).