8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine

C19H20N6O — CID 53250348

IUPAC8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOc1ccc(C)n2nc(CCc3nc(-c4cccnc4)cn3C)nc12
InChIInChI=1S/C19H20N6O/c1-13-6-7-16(26-3)19-22-17(23-25(13)19)8-9-18-21-15(12-24(18)2)14-5-4-10-20-11-14/h4-7,10-12H,8-9H2,1-3H3
InChIKeyRARBFOPTFWEENY-UHFFFAOYSA-N
MW348.41 g/mol
LogP2.63
Rot. Bonds5

About 8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine

8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 53250348) has the molecular formula C19H20N6O and a molecular weight of 348.41 g/mol. Its IUPAC name is 8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID53250348
Molecular FormulaC19H20N6O
Molecular Weight348.41 g/mol
Exact Mass348.17
IUPAC Name8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOc1ccc(C)n2nc(CCc3nc(-c4cccnc4)cn3C)nc12
InChIInChI=1S/C19H20N6O/c1-13-6-7-16(26-3)19-22-17(23-25(13)19)8-9-18-21-15(12-24(18)2)14-5-4-10-20-11-14/h4-7,10-12H,8-9H2,1-3H3
InChIKeyRARBFOPTFWEENY-UHFFFAOYSA-N
XLogP2.63
TPSA70.13 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine (CID 53250348) is 8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine is COc1ccc(C)n2nc(CCc3nc(-c4cccnc4)cn3C)nc12.
What is the InChIKey of 8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is RARBFOPTFWEENY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O/c1-13-6-7-16(26-3)19-22-17(23-25(13)19)8-9-18-21-15(12-24(18)2)14-5-4-10-20-11-14/h4-7,10-12H,8-9H2,1-3H3.
What are the key properties of 8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine?
8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 348.41 g/mol, XLogP of 2.63, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-5-methyl-2-[2-(1-methyl-4-pyridin-3-ylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 53250348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).