2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid

C15H12N2O3 — CID 136986657

IUPAC2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid
SMILESCn1c(-c2cc(C(=O)O)ccn2)cc2ccc(O)cc21
InChIInChI=1S/C15H12N2O3/c1-17-13-8-11(18)3-2-9(13)7-14(17)12-6-10(15(19)20)4-5-16-12/h2-8,18H,1H3,(H,19,20)
InChIKeyZPKCPVATNAYKSB-UHFFFAOYSA-N
MW268.27 g/mol
LogP2.64
Rot. Bonds2

About 2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid

2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid (PubChem CID 136986657) has the molecular formula C15H12N2O3 and a molecular weight of 268.27 g/mol. Its IUPAC name is 2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid
PubChem CID136986657
Molecular FormulaC15H12N2O3
Molecular Weight268.27 g/mol
Exact Mass268.08
IUPAC Name2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid
SMILESCn1c(-c2cc(C(=O)O)ccn2)cc2ccc(O)cc21
InChIInChI=1S/C15H12N2O3/c1-17-13-8-11(18)3-2-9(13)7-14(17)12-6-10(15(19)20)4-5-16-12/h2-8,18H,1H3,(H,19,20)
InChIKeyZPKCPVATNAYKSB-UHFFFAOYSA-N
XLogP2.64
TPSA75.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-chloro-1-methylindol-2-yl)pyridine-4-carboxylic acid
CID 115113963
2-(6-hydroxy-1-methylindol-3-yl)pyridine-4-carboxylic acid
CID 115114136
5-(6-hydroxy-1-methylindol-2-yl)-1-methylpyrazole-4-carboxylic acid
CID 136986454
bis(2-(4-carboxy-2-pyridinyl)pyridine-4-carboxylic acid);oxalic acid;ruthenium
CID 11982105
2-(1-methylimidazol-2-yl)pyridine-4-carboxylic acid
CID 84671306
2-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-4-carboxylic acid
CID 71289011
2-(6-methyl-1-benzofuran-2-yl)pyridine-4-carboxylic acid
CID 115113829
3-amino-6-(4-carboxy-2-pyridinyl)pyridine-2-carboxylic acid
CID 140591026
2-(4-carboxy-2-pyridinyl)pyridine-4-carboxylic acid;bis(2-pyridin-2-ylpyridine);ruthenium
CID 14951635
2-pyridin-2-ylpyridine-4-carboxylic acid;dihydrochloride
CID 91928344
2-(4-carboxy-2-pyridinyl)pyridine-4-carboxylic acid;osmium;bis(2-pyridin-2-ylpyridine)
CID 162025014
2-(furan-3-yl)pyridine-4-carboxylic acid
CID 91623804

Frequently Asked Questions

What is the IUPAC name of 2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid?
The IUPAC name of 2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid (CID 136986657) is 2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid.
What is the SMILES notation for 2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid?
The canonical SMILES for 2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid is Cn1c(-c2cc(C(=O)O)ccn2)cc2ccc(O)cc21.
What is the InChIKey of 2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid?
The InChIKey is ZPKCPVATNAYKSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3/c1-17-13-8-11(18)3-2-9(13)7-14(17)12-6-10(15(19)20)4-5-16-12/h2-8,18H,1H3,(H,19,20).
What are the key properties of 2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid?
2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid has a molecular weight of 268.27 g/mol, XLogP of 2.64, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-hydroxy-1-methylindol-2-yl)pyridine-4-carboxylic acid is sourced from PubChem (CID 136986657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).