8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine

C11H14N4O — CID 84750915

IUPAC8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
SMILESCOc1cccn2c(C3CCCN3)nnc12
InChIInChI=1S/C11H14N4O/c1-16-9-5-3-7-15-10(13-14-11(9)15)8-4-2-6-12-8/h3,5,7-8,12H,2,4,6H2,1H3
InChIKeyVXTTULILPFTXCX-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.16
Rot. Bonds2

About 8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine

8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 84750915) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID84750915
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
SMILESCOc1cccn2c(C3CCCN3)nnc12
InChIInChI=1S/C11H14N4O/c1-16-9-5-3-7-15-10(13-14-11(9)15)8-4-2-6-12-8/h3,5,7-8,12H,2,4,6H2,1H3
InChIKeyVXTTULILPFTXCX-UHFFFAOYSA-N
XLogP1.16
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

8-ethoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 84750916
8-methyl-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 84750908
1-bromo-8-methoxy-3-pyrrolidin-2-ylimidazo[1,5-a]pyridine
CID 117254809
8-methoxy-3-(1-methylpiperidin-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117145448
2-(8-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)thiolane 1,1-dioxide
CID 117145429
2-(8-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)thiane 1,1-dioxide
CID 117145442
8-methoxy-2-piperidin-2-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 117136536
8-methoxy-2-piperidin-2-ylimidazo[1,2-a]pyridine
CID 115038434
3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 24711632
(2R)-2-(2-methoxyphenyl)pyrrolidine
CID 7047810
3-cyclobutyl-N-(2-methoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 86764840
6-fluoro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 84750912

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine (CID 84750915) is 8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine is COc1cccn2c(C3CCCN3)nnc12.
What is the InChIKey of 8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is VXTTULILPFTXCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-16-9-5-3-7-15-10(13-14-11(9)15)8-4-2-6-12-8/h3,5,7-8,12H,2,4,6H2,1H3.
What are the key properties of 8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine?
8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 218.26 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 84750915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).