5-(2-methoxyethoxy)-1H-indole

C11H13NO2 — CID 10352537

IUPAC5-(2-methoxyethoxy)-1H-indole
SMILESCOCCOc1ccc2[nH]ccc2c1
InChIInChI=1S/C11H13NO2/c1-13-6-7-14-10-2-3-11-9(8-10)4-5-12-11/h2-5,8,12H,6-7H2,1H3
InChIKeyFPLAYGBHGUOPLD-UHFFFAOYSA-N
MW191.23 g/mol
LogP2.19
Rot. Bonds4

About 5-(2-methoxyethoxy)-1H-indole

5-(2-methoxyethoxy)-1H-indole (PubChem CID 10352537) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is 5-(2-methoxyethoxy)-1H-indole.

Molecular Properties

Compound Name5-(2-methoxyethoxy)-1H-indole
PubChem CID10352537
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name5-(2-methoxyethoxy)-1H-indole
SMILESCOCCOc1ccc2[nH]ccc2c1
InChIInChI=1S/C11H13NO2/c1-13-6-7-14-10-2-3-11-9(8-10)4-5-12-11/h2-5,8,12H,6-7H2,1H3
InChIKeyFPLAYGBHGUOPLD-UHFFFAOYSA-N
XLogP2.19
TPSA34.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 5-(2-methoxyethoxy)-1H-indole?
The IUPAC name of 5-(2-methoxyethoxy)-1H-indole (CID 10352537) is 5-(2-methoxyethoxy)-1H-indole.
What is the SMILES notation for 5-(2-methoxyethoxy)-1H-indole?
The canonical SMILES for 5-(2-methoxyethoxy)-1H-indole is COCCOc1ccc2[nH]ccc2c1.
What is the InChIKey of 5-(2-methoxyethoxy)-1H-indole?
The InChIKey is FPLAYGBHGUOPLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c1-13-6-7-14-10-2-3-11-9(8-10)4-5-12-11/h2-5,8,12H,6-7H2,1H3.
What are the key properties of 5-(2-methoxyethoxy)-1H-indole?
5-(2-methoxyethoxy)-1H-indole has a molecular weight of 191.23 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyethoxy)-1H-indole is sourced from PubChem (CID 10352537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).