6-(5-methoxyindol-1-yl)hexan-1-ol

C15H21NO2 — CID 107707082

IUPAC6-(5-methoxyindol-1-yl)hexan-1-ol
SMILESCOc1ccc2c(ccn2CCCCCCO)c1
InChIInChI=1S/C15H21NO2/c1-18-14-6-7-15-13(12-14)8-10-16(15)9-4-2-3-5-11-17/h6-8,10,12,17H,2-5,9,11H2,1H3
InChIKeyWQEXXOYYIDCTIB-UHFFFAOYSA-N
MW247.34 g/mol
LogP3.20
Rot. Bonds7

About 6-(5-methoxyindol-1-yl)hexan-1-ol

6-(5-methoxyindol-1-yl)hexan-1-ol (PubChem CID 107707082) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 6-(5-methoxyindol-1-yl)hexan-1-ol.

Molecular Properties

Compound Name6-(5-methoxyindol-1-yl)hexan-1-ol
PubChem CID107707082
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name6-(5-methoxyindol-1-yl)hexan-1-ol
SMILESCOc1ccc2c(ccn2CCCCCCO)c1
InChIInChI=1S/C15H21NO2/c1-18-14-6-7-15-13(12-14)8-10-16(15)9-4-2-3-5-11-17/h6-8,10,12,17H,2-5,9,11H2,1H3
InChIKeyWQEXXOYYIDCTIB-UHFFFAOYSA-N
XLogP3.20
TPSA34.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(5-methoxyindol-1-yl)hexan-1-ol?
The IUPAC name of 6-(5-methoxyindol-1-yl)hexan-1-ol (CID 107707082) is 6-(5-methoxyindol-1-yl)hexan-1-ol.
What is the SMILES notation for 6-(5-methoxyindol-1-yl)hexan-1-ol?
The canonical SMILES for 6-(5-methoxyindol-1-yl)hexan-1-ol is COc1ccc2c(ccn2CCCCCCO)c1.
What is the InChIKey of 6-(5-methoxyindol-1-yl)hexan-1-ol?
The InChIKey is WQEXXOYYIDCTIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-18-14-6-7-15-13(12-14)8-10-16(15)9-4-2-3-5-11-17/h6-8,10,12,17H,2-5,9,11H2,1H3.
What are the key properties of 6-(5-methoxyindol-1-yl)hexan-1-ol?
6-(5-methoxyindol-1-yl)hexan-1-ol has a molecular weight of 247.34 g/mol, XLogP of 3.20, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-methoxyindol-1-yl)hexan-1-ol is sourced from PubChem (CID 107707082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).