2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine

C12H17N3O — CID 103020933

IUPAC2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine
SMILESCOC(C)(C)Cc1nc2nc(C)ccc2[nH]1
InChIInChI=1S/C12H17N3O/c1-8-5-6-9-11(13-8)15-10(14-9)7-12(2,3)16-4/h5-6H,7H2,1-4H3,(H,13,14,15)
InChIKeyZHPDEIGUWDLSOG-UHFFFAOYSA-N
MW219.29 g/mol
LogP2.23
Rot. Bonds3

About 2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine

2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine (PubChem CID 103020933) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine
PubChem CID103020933
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine
SMILESCOC(C)(C)Cc1nc2nc(C)ccc2[nH]1
InChIInChI=1S/C12H17N3O/c1-8-5-6-9-11(13-8)15-10(14-9)7-12(2,3)16-4/h5-6H,7H2,1-4H3,(H,13,14,15)
InChIKeyZHPDEIGUWDLSOG-UHFFFAOYSA-N
XLogP2.23
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine (CID 103020933) is 2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine is COC(C)(C)Cc1nc2nc(C)ccc2[nH]1.
What is the InChIKey of 2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine?
The InChIKey is ZHPDEIGUWDLSOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-8-5-6-9-11(13-8)15-10(14-9)7-12(2,3)16-4/h5-6H,7H2,1-4H3,(H,13,14,15).
What are the key properties of 2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine?
2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine has a molecular weight of 219.29 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-2-methylpropyl)-5-methyl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 103020933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).