1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid

C9H8N2O2 — CID 137347030

IUPAC1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid
SMILESCn1ccc2c(C(=O)O)nccc21
InChIInChI=1S/C9H8N2O2/c1-11-5-3-6-7(11)2-4-10-8(6)9(12)13/h2-5H,1H3,(H,12,13)
InChIKeyVRONOJUASJQMAV-UHFFFAOYSA-N
MW176.17 g/mol
LogP1.27
Rot. Bonds1

About 1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid

1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid (PubChem CID 137347030) has the molecular formula C9H8N2O2 and a molecular weight of 176.17 g/mol. Its IUPAC name is 1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid
PubChem CID137347030
Molecular FormulaC9H8N2O2
Molecular Weight176.17 g/mol
Exact Mass176.06
IUPAC Name1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid
SMILESCn1ccc2c(C(=O)O)nccc21
InChIInChI=1S/C9H8N2O2/c1-11-5-3-6-7(11)2-4-10-8(6)9(12)13/h2-5H,1H3,(H,12,13)
InChIKeyVRONOJUASJQMAV-UHFFFAOYSA-N
XLogP1.27
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.17
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methylimidazo[4,5-c]pyridine-4-carboxylic acid
CID 84655857
2-(1-methylpyrrolo[3,2-c]pyridin-4-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone
CID 50838812
2-methyl-1H-pyrrolo[3,2-c]pyridine-4-carboxylic acid
CID 130047563
1-(1-methylpyrrolo[3,2-c]pyridin-4-yl)pyrimidine-2,4-dione
CID 170164664
1-(1-methylpyrrolo[2,3-c]pyridin-7-yl)ethanone
CID 154728478
1-methylfuro[3,4-c]pyridine-4-carboxylic acid
CID 82410647
4-methyl-3-(triazol-2-yl)pyridine-2-carboxylic acid
CID 90412496
5,6-dimethylpyrido[4,3-b]carbazole-1-carboxylic acid
CID 162755099
1-[4-(4-fluorophenyl)piperazin-1-yl]-2-(1-methylpyrrolo[3,2-c]pyridin-4-yl)sulfanylethanone
CID 50838853
palladium;pyrazine-2,3-dicarboxylic acid
CID 174785540
1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide
CID 134712669
5-(4-chloro-1-methylindol-6-yl)-1,2-oxazole-3-carboxylic acid
CID 117443276

Frequently Asked Questions

What is the IUPAC name of 1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid?
The IUPAC name of 1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid (CID 137347030) is 1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid.
What is the SMILES notation for 1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid?
The canonical SMILES for 1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid is Cn1ccc2c(C(=O)O)nccc21.
What is the InChIKey of 1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid?
The InChIKey is VRONOJUASJQMAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2/c1-11-5-3-6-7(11)2-4-10-8(6)9(12)13/h2-5H,1H3,(H,12,13).
What are the key properties of 1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid?
1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid has a molecular weight of 176.17 g/mol, XLogP of 1.27, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid is sourced from PubChem (CID 137347030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).