5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine

C13H18N4O — CID 117132123

IUPAC5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOc1cccc2nc(CC3CCCCN3)nn12
InChIInChI=1S/C13H18N4O/c1-18-13-7-4-6-12-15-11(16-17(12)13)9-10-5-2-3-8-14-10/h4,6-7,10,14H,2-3,5,8-9H2,1H3
InChIKeyHZOQNDPMTLULCE-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.42
Rot. Bonds3

About 5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine

5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 117132123) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID117132123
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOc1cccc2nc(CC3CCCCN3)nn12
InChIInChI=1S/C13H18N4O/c1-18-13-7-4-6-12-15-11(16-17(12)13)9-10-5-2-3-8-14-10/h4,6-7,10,14H,2-3,5,8-9H2,1H3
InChIKeyHZOQNDPMTLULCE-UHFFFAOYSA-N
XLogP1.42
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-(pyrrolidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate
CID 117132105
2-[(5-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methyl]thiane 1,1-dioxide
CID 117132118
4-[(5-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methyl]thiane 1,1-dioxide
CID 117131468
7-methoxy-2-(pyrrolidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117134373
5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine
CID 117231656
4-methoxy-1-methyl-2-(piperidin-2-ylmethyl)benzimidazole
CID 84637903
2-methoxy-4-(piperidin-2-ylmethyl)-1,3-benzoxazole
CID 117368074
4-methyl-2-(piperidin-2-ylmethyl)-6-(1H-pyrrol-2-yl)pyrimidine
CID 116893520
3-(5-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiane 1,1-dioxide
CID 117131596
4-tert-butyl-6-methoxy-2-(piperidin-2-ylmethyl)pyrimidine
CID 82666688
2-[(5-methoxy-3-methylpyrazol-1-yl)methyl]piperidine
CID 84722956
3-(5-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl)thiolane 1,1-dioxide
CID 117131081

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine (CID 117132123) is 5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine is COc1cccc2nc(CC3CCCCN3)nn12.
What is the InChIKey of 5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is HZOQNDPMTLULCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-18-13-7-4-6-12-15-11(16-17(12)13)9-10-5-2-3-8-14-10/h4,6-7,10,14H,2-3,5,8-9H2,1H3.
What are the key properties of 5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine?
5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 246.31 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-(piperidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 117132123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).