2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid

C11H11N3O2 — CID 79795345

IUPAC2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid
SMILESCc1cnc2nc(C3CC3C(=O)O)[nH]c2c1
InChIInChI=1S/C11H11N3O2/c1-5-2-8-10(12-4-5)14-9(13-8)6-3-7(6)11(15)16/h2,4,6-7H,3H2,1H3,(H,15,16)(H,12,13,14)
InChIKeyBZQIOMFGBYXLAN-UHFFFAOYSA-N
MW217.23 g/mol
LogP1.45
Rot. Bonds2

About 2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid

2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid (PubChem CID 79795345) has the molecular formula C11H11N3O2 and a molecular weight of 217.23 g/mol. Its IUPAC name is 2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid.

Molecular Properties

Compound Name2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid
PubChem CID79795345
Molecular FormulaC11H11N3O2
Molecular Weight217.23 g/mol
Exact Mass217.09
IUPAC Name2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid
SMILESCc1cnc2nc(C3CC3C(=O)O)[nH]c2c1
InChIInChI=1S/C11H11N3O2/c1-5-2-8-10(12-4-5)14-9(13-8)6-3-7(6)11(15)16/h2,4,6-7H,3H2,1H3,(H,15,16)(H,12,13,14)
InChIKeyBZQIOMFGBYXLAN-UHFFFAOYSA-N
XLogP1.45
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid?
The IUPAC name of 2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid (CID 79795345) is 2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid.
What is the SMILES notation for 2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid?
The canonical SMILES for 2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid is Cc1cnc2nc(C3CC3C(=O)O)[nH]c2c1.
What is the InChIKey of 2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid?
The InChIKey is BZQIOMFGBYXLAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2/c1-5-2-8-10(12-4-5)14-9(13-8)6-3-7(6)11(15)16/h2,4,6-7H,3H2,1H3,(H,15,16)(H,12,13,14).
What are the key properties of 2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid?
2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid has a molecular weight of 217.23 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid is sourced from PubChem (CID 79795345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).