2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine

C11H11N5O — CID 136999094

IUPAC2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine
SMILESCOc1cc(-c2nc3ccncc3[nH]2)nn1C
InChIInChI=1S/C11H11N5O/c1-16-10(17-2)5-8(15-16)11-13-7-3-4-12-6-9(7)14-11/h3-6H,1-2H3,(H,13,14)
InChIKeyOVNWCSVAKORGJD-UHFFFAOYSA-N
MW229.24 g/mol
LogP1.37
Rot. Bonds2

About 2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine

2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine (PubChem CID 136999094) has the molecular formula C11H11N5O and a molecular weight of 229.24 g/mol. Its IUPAC name is 2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine
PubChem CID136999094
Molecular FormulaC11H11N5O
Molecular Weight229.24 g/mol
Exact Mass229.10
IUPAC Name2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine
SMILESCOc1cc(-c2nc3ccncc3[nH]2)nn1C
InChIInChI=1S/C11H11N5O/c1-16-10(17-2)5-8(15-16)11-13-7-3-4-12-6-9(7)14-11/h3-6H,1-2H3,(H,13,14)
InChIKeyOVNWCSVAKORGJD-UHFFFAOYSA-N
XLogP1.37
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine?
The IUPAC name of 2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine (CID 136999094) is 2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine?
The canonical SMILES for 2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine is COc1cc(-c2nc3ccncc3[nH]2)nn1C.
What is the InChIKey of 2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine?
The InChIKey is OVNWCSVAKORGJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5O/c1-16-10(17-2)5-8(15-16)11-13-7-3-4-12-6-9(7)14-11/h3-6H,1-2H3,(H,13,14).
What are the key properties of 2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine?
2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine has a molecular weight of 229.24 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxy-1-methylpyrazol-3-yl)-3H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 136999094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).