2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid

C9H9N3O2 — CID 82061378

IUPAC2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid
SMILESCc1cnc2c(c1)ncn2CC(=O)O
InChIInChI=1S/C9H9N3O2/c1-6-2-7-9(10-3-6)12(5-11-7)4-8(13)14/h2-3,5H,4H2,1H3,(H,13,14)
InChIKeyFODKSLSHUBXBAK-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.82
Rot. Bonds2

About 2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid

2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid (PubChem CID 82061378) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is 2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid.

Molecular Properties

Compound Name2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid
PubChem CID82061378
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Name2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid
SMILESCc1cnc2c(c1)ncn2CC(=O)O
InChIInChI=1S/C9H9N3O2/c1-6-2-7-9(10-3-6)12(5-11-7)4-8(13)14/h2-3,5H,4H2,1H3,(H,13,14)
InChIKeyFODKSLSHUBXBAK-UHFFFAOYSA-N
XLogP0.82
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6-bromoimidazo[4,5-b]pyridin-3-yl)acetic acid
CID 82061401
5-[(6-methylimidazo[4,5-b]pyridin-3-yl)methyl]furan-2-carboxylic acid
CID 82061397
2-(5-methylpyrrolo[2,3-b]pyridin-1-yl)acetic acid
CID 117223851
2-(7-methylbenzimidazol-1-yl)acetic acid
CID 11735640
2-[2-(2-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]acetic acid
CID 82061424
2-[2-(3-chlorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]acetic acid
CID 82061437
3-(2-ethyl-6-methylimidazo[4,5-b]pyridin-3-yl)propanoic acid
CID 82061501
2-(6-hydroxybenzimidazol-1-yl)acetic acid
CID 84772237
2-(6-methoxybenzimidazol-1-yl)acetic acid
CID 84778979
2-methyl-4-[2-(6-methylimidazo[4,5-b]pyridin-3-yl)ethoxy]aniline
CID 82152127
3-(carboxymethyl)benzimidazole-5-carboxylic acid
CID 16763194
2-(2-methylimidazol-1-yl)acetic acid;zinc
CID 175370537

Frequently Asked Questions

What is the IUPAC name of 2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid?
The IUPAC name of 2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid (CID 82061378) is 2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid.
What is the SMILES notation for 2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid?
The canonical SMILES for 2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid is Cc1cnc2c(c1)ncn2CC(=O)O.
What is the InChIKey of 2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid?
The InChIKey is FODKSLSHUBXBAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c1-6-2-7-9(10-3-6)12(5-11-7)4-8(13)14/h2-3,5H,4H2,1H3,(H,13,14).
What are the key properties of 2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid?
2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid has a molecular weight of 191.19 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methylimidazo[4,5-b]pyridin-3-yl)acetic acid is sourced from PubChem (CID 82061378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).