2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine

C19H17N7O — CID 175276141

IUPAC2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine
SMILESCOc1ccc2[nH]ncc2c1-c1cn(Cc2cn3cc(C)ccc3n2)nn1
InChIInChI=1S/C19H17N7O/c1-12-3-6-18-21-13(9-25(18)8-12)10-26-11-16(23-24-26)19-14-7-20-22-15(14)4-5-17(19)27-2/h3-9,11H,10H2,1-2H3,(H,20,22)
InChIKeyHETRXHNSEJYAGE-UHFFFAOYSA-N
MW359.39 g/mol
LogP2.83
Rot. Bonds4

About 2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine

2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine (PubChem CID 175276141) has the molecular formula C19H17N7O and a molecular weight of 359.39 g/mol. Its IUPAC name is 2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine
PubChem CID175276141
Molecular FormulaC19H17N7O
Molecular Weight359.39 g/mol
Exact Mass359.15
IUPAC Name2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine
SMILESCOc1ccc2[nH]ncc2c1-c1cn(Cc2cn3cc(C)ccc3n2)nn1
InChIInChI=1S/C19H17N7O/c1-12-3-6-18-21-13(9-25(18)8-12)10-26-11-16(23-24-26)19-14-7-20-22-15(14)4-5-17(19)27-2/h3-9,11H,10H2,1-2H3,(H,20,22)
InChIKeyHETRXHNSEJYAGE-UHFFFAOYSA-N
XLogP2.83
TPSA85.92 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine?
The IUPAC name of 2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine (CID 175276141) is 2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine?
The canonical SMILES for 2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine is COc1ccc2[nH]ncc2c1-c1cn(Cc2cn3cc(C)ccc3n2)nn1.
What is the InChIKey of 2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine?
The InChIKey is HETRXHNSEJYAGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N7O/c1-12-3-6-18-21-13(9-25(18)8-12)10-26-11-16(23-24-26)19-14-7-20-22-15(14)4-5-17(19)27-2/h3-9,11H,10H2,1-2H3,(H,20,22).
What are the key properties of 2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine?
2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine has a molecular weight of 359.39 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine is sourced from PubChem (CID 175276141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).