1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid

C10H10N2O3 — CID 117275923

IUPAC1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid
SMILESO=C(O)c1cnc2c(ccn2CCO)c1
InChIInChI=1S/C10H10N2O3/c13-4-3-12-2-1-7-5-8(10(14)15)6-11-9(7)12/h1-2,5-6,13H,3-4H2,(H,14,15)
InChIKeyFBMRJQCHLBGERE-UHFFFAOYSA-N
MW206.20 g/mol
LogP0.73
Rot. Bonds3

About 1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid

1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid (PubChem CID 117275923) has the molecular formula C10H10N2O3 and a molecular weight of 206.20 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid.

Molecular Properties

Compound Name1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid
PubChem CID117275923
Molecular FormulaC10H10N2O3
Molecular Weight206.20 g/mol
Exact Mass206.07
IUPAC Name1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid
SMILESO=C(O)c1cnc2c(ccn2CCO)c1
InChIInChI=1S/C10H10N2O3/c13-4-3-12-2-1-7-5-8(10(14)15)6-11-9(7)12/h1-2,5-6,13H,3-4H2,(H,14,15)
InChIKeyFBMRJQCHLBGERE-UHFFFAOYSA-N
XLogP0.73
TPSA75.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-hydroxyethyl)-7-methylindole-5-carboxylic acid
CID 83945940
1-[[2-(2-ethylbutoxy)-5-(trifluoromethoxy)phenyl]methyl]pyrrolo[2,3-b]pyridine-5-carboxylic acid
CID 71626445
2-(5-methylpyrrolo[2,3-b]pyridin-1-yl)acetic acid
CID 117223851
2-(5-chloropyrrolo[2,3-b]pyridin-1-yl)-1-piperidin-1-ylethanone
CID 141178949
1-methylpyrrolo[2,3-b]pyridine-5-carboxamide
CID 141014223
1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine-5-carbonyl chloride
CID 165343915
1-chloropyrazolo[3,4-b]pyridine-5-carboxylic acid
CID 141410941
5-chloro-6-[4-(2-hydroxyethyl)piperazin-1-yl]pyridine-3-carboxylic acid
CID 43592266
2-(5-chloropyrrolo[2,3-b]pyridin-1-yl)-N-methylethanamine
CID 117223833
1-(1-phenylpyrrolo[2,3-b]pyridin-5-yl)ethanone
CID 165056065
2-(5-bromopyrrolo[2,3-b]pyridin-1-yl)ethanamine
CID 117223836
2-(2,2-dimethylpropyl)-3-methylimidazo[4,5-b]pyridine-6-carboxylic acid
CID 82479909

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid?
The IUPAC name of 1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid (CID 117275923) is 1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid.
What is the SMILES notation for 1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid?
The canonical SMILES for 1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid is O=C(O)c1cnc2c(ccn2CCO)c1.
What is the InChIKey of 1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid?
The InChIKey is FBMRJQCHLBGERE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O3/c13-4-3-12-2-1-7-5-8(10(14)15)6-11-9(7)12/h1-2,5-6,13H,3-4H2,(H,14,15).
What are the key properties of 1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid?
1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid has a molecular weight of 206.20 g/mol, XLogP of 0.73, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid is sourced from PubChem (CID 117275923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).