7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid

C15H12N2O4 — CID 58237078

IUPAC7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid
SMILESCc1ccc(Oc2cc(O)c3[nH]c(C(=O)O)cc3c2)cn1
InChIInChI=1S/C15H12N2O4/c1-8-2-3-10(7-16-8)21-11-4-9-5-12(15(19)20)17-14(9)13(18)6-11/h2-7,17-18H,1H3,(H,19,20)
InChIKeyFDMKMUADDROCJX-UHFFFAOYSA-N
MW284.27 g/mol
LogP3.07
Rot. Bonds3

About 7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid

7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid (PubChem CID 58237078) has the molecular formula C15H12N2O4 and a molecular weight of 284.27 g/mol. Its IUPAC name is 7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid.

Molecular Properties

Compound Name7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid
PubChem CID58237078
Molecular FormulaC15H12N2O4
Molecular Weight284.27 g/mol
Exact Mass284.08
IUPAC Name7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid
SMILESCc1ccc(Oc2cc(O)c3[nH]c(C(=O)O)cc3c2)cn1
InChIInChI=1S/C15H12N2O4/c1-8-2-3-10(7-16-8)21-11-4-9-5-12(15(19)20)17-14(9)13(18)6-11/h2-7,17-18H,1H3,(H,19,20)
InChIKeyFDMKMUADDROCJX-UHFFFAOYSA-N
XLogP3.07
TPSA95.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.27
LogP ≤ 53.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid?
The IUPAC name of 7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid (CID 58237078) is 7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid.
What is the SMILES notation for 7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid?
The canonical SMILES for 7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid is Cc1ccc(Oc2cc(O)c3[nH]c(C(=O)O)cc3c2)cn1.
What is the InChIKey of 7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid?
The InChIKey is FDMKMUADDROCJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O4/c1-8-2-3-10(7-16-8)21-11-4-9-5-12(15(19)20)17-14(9)13(18)6-11/h2-7,17-18H,1H3,(H,19,20).
What are the key properties of 7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid?
7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid has a molecular weight of 284.27 g/mol, XLogP of 3.07, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-5-[(6-methyl-3-pyridinyl)oxy]-1H-indole-2-carboxylic acid is sourced from PubChem (CID 58237078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).