3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one

C14H12N2O3 — CID 163232483

IUPAC3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one
SMILESCOc1ccc(C2(O)C(=O)Nc3ccccc32)cn1
InChIInChI=1S/C14H12N2O3/c1-19-12-7-6-9(8-15-12)14(18)10-4-2-3-5-11(10)16-13(14)17/h2-8,18H,1H3,(H,16,17)
InChIKeyNQLDWRMIJKRTAH-UHFFFAOYSA-N
MW256.26 g/mol
LogP1.28
Rot. Bonds2

About 3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one

3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one (PubChem CID 163232483) has the molecular formula C14H12N2O3 and a molecular weight of 256.26 g/mol. Its IUPAC name is 3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one.

Molecular Properties

Compound Name3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one
PubChem CID163232483
Molecular FormulaC14H12N2O3
Molecular Weight256.26 g/mol
Exact Mass256.08
IUPAC Name3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one
SMILESCOc1ccc(C2(O)C(=O)Nc3ccccc32)cn1
InChIInChI=1S/C14H12N2O3/c1-19-12-7-6-9(8-15-12)14(18)10-4-2-3-5-11(10)16-13(14)17/h2-8,18H,1H3,(H,16,17)
InChIKeyNQLDWRMIJKRTAH-UHFFFAOYSA-N
XLogP1.28
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one 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 3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one?
The IUPAC name of 3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one (CID 163232483) is 3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one.
What is the SMILES notation for 3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one?
The canonical SMILES for 3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one is COc1ccc(C2(O)C(=O)Nc3ccccc32)cn1.
What is the InChIKey of 3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one?
The InChIKey is NQLDWRMIJKRTAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O3/c1-19-12-7-6-9(8-15-12)14(18)10-4-2-3-5-11(10)16-13(14)17/h2-8,18H,1H3,(H,16,17).
What are the key properties of 3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one?
3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one has a molecular weight of 256.26 g/mol, XLogP of 1.28, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-3-(6-methoxy-3-pyridinyl)-1H-indol-2-one is sourced from PubChem (CID 163232483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).