8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine

C17H16N4O — CID 137376081

IUPAC8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOCc1cccn2nc(-c3ccc4c(ccn4C)c3)nc12
InChIInChI=1S/C17H16N4O/c1-20-9-7-12-10-13(5-6-15(12)20)16-18-17-14(11-22-2)4-3-8-21(17)19-16/h3-10H,11H2,1-2H3
InChIKeyMMUFTFIIHNSIHM-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.03
Rot. Bonds3

About 8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine

8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 137376081) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is 8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID137376081
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC Name8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOCc1cccn2nc(-c3ccc4c(ccn4C)c3)nc12
InChIInChI=1S/C17H16N4O/c1-20-9-7-12-10-13(5-6-15(12)20)16-18-17-14(11-22-2)4-3-8-21(17)19-16/h3-10H,11H2,1-2H3
InChIKeyMMUFTFIIHNSIHM-UHFFFAOYSA-N
XLogP3.03
TPSA44.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine (CID 137376081) is 8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine is COCc1cccn2nc(-c3ccc4c(ccn4C)c3)nc12.
What is the InChIKey of 8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is MMUFTFIIHNSIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c1-20-9-7-12-10-13(5-6-15(12)20)16-18-17-14(11-22-2)4-3-8-21(17)19-16/h3-10H,11H2,1-2H3.
What are the key properties of 8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine?
8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 292.34 g/mol, XLogP of 3.03, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(methoxymethyl)-2-(1-methylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 137376081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).