1-methoxyindol-6-ol

C9H9NO2 — CID 69254132

IUPAC1-methoxyindol-6-ol
SMILESCOn1ccc2ccc(O)cc21
InChIInChI=1S/C9H9NO2/c1-12-10-5-4-7-2-3-8(11)6-9(7)10/h2-6,11H,1H3
InChIKeyNJRPJGPJZAYIFQ-UHFFFAOYSA-N
MW163.18 g/mol
LogP1.41
Rot. Bonds1

About 1-methoxyindol-6-ol

1-methoxyindol-6-ol (PubChem CID 69254132) has the molecular formula C9H9NO2 and a molecular weight of 163.18 g/mol. Its IUPAC name is 1-methoxyindol-6-ol.

Molecular Properties

Compound Name1-methoxyindol-6-ol
PubChem CID69254132
Molecular FormulaC9H9NO2
Molecular Weight163.18 g/mol
Exact Mass163.06
IUPAC Name1-methoxyindol-6-ol
SMILESCOn1ccc2ccc(O)cc21
InChIInChI=1S/C9H9NO2/c1-12-10-5-4-7-2-3-8(11)6-9(7)10/h2-6,11H,1H3
InChIKeyNJRPJGPJZAYIFQ-UHFFFAOYSA-N
XLogP1.41
TPSA34.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methoxyindol-6-ol?
The IUPAC name of 1-methoxyindol-6-ol (CID 69254132) is 1-methoxyindol-6-ol.
What is the SMILES notation for 1-methoxyindol-6-ol?
The canonical SMILES for 1-methoxyindol-6-ol is COn1ccc2ccc(O)cc21.
What is the InChIKey of 1-methoxyindol-6-ol?
The InChIKey is NJRPJGPJZAYIFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO2/c1-12-10-5-4-7-2-3-8(11)6-9(7)10/h2-6,11H,1H3.
What are the key properties of 1-methoxyindol-6-ol?
1-methoxyindol-6-ol has a molecular weight of 163.18 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxyindol-6-ol is sourced from PubChem (CID 69254132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).