6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid

C14H10N2O3 — CID 136986560

IUPAC6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(-c2cc3c(O)cccc3[nH]2)nc1
InChIInChI=1S/C14H10N2O3/c17-13-3-1-2-10-9(13)6-12(16-10)11-5-4-8(7-15-11)14(18)19/h1-7,16-17H,(H,18,19)
InChIKeyDBPGEOIPVYUPEP-UHFFFAOYSA-N
MW254.25 g/mol
LogP2.63
Rot. Bonds2

About 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid

6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid (PubChem CID 136986560) has the molecular formula C14H10N2O3 and a molecular weight of 254.25 g/mol. Its IUPAC name is 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid
PubChem CID136986560
Molecular FormulaC14H10N2O3
Molecular Weight254.25 g/mol
Exact Mass254.07
IUPAC Name6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(-c2cc3c(O)cccc3[nH]2)nc1
InChIInChI=1S/C14H10N2O3/c17-13-3-1-2-10-9(13)6-12(16-10)11-5-4-8(7-15-11)14(18)19/h1-7,16-17H,(H,18,19)
InChIKeyDBPGEOIPVYUPEP-UHFFFAOYSA-N
XLogP2.63
TPSA86.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 52.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid?
The IUPAC name of 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid (CID 136986560) is 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid.
What is the SMILES notation for 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid?
The canonical SMILES for 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid is O=C(O)c1ccc(-c2cc3c(O)cccc3[nH]2)nc1.
What is the InChIKey of 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid?
The InChIKey is DBPGEOIPVYUPEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O3/c17-13-3-1-2-10-9(13)6-12(16-10)11-5-4-8(7-15-11)14(18)19/h1-7,16-17H,(H,18,19).
What are the key properties of 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid?
6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid has a molecular weight of 254.25 g/mol, XLogP of 2.63, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid is sourced from PubChem (CID 136986560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).