2-(4-methyl-2,3-dihydroindol-1-yl)ethanol

C11H15NO — CID 131065584

IUPAC2-(4-methyl-2,3-dihydroindol-1-yl)ethanol
SMILESCc1cccc2c1CCN2CCO
InChIInChI=1S/C11H15NO/c1-9-3-2-4-11-10(9)5-6-12(11)7-8-13/h2-4,13H,5-8H2,1H3
InChIKeyDKYGQSYBQIDRMO-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.35
Rot. Bonds2

About 2-(4-methyl-2,3-dihydroindol-1-yl)ethanol

2-(4-methyl-2,3-dihydroindol-1-yl)ethanol (PubChem CID 131065584) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-(4-methyl-2,3-dihydroindol-1-yl)ethanol.

Molecular Properties

Compound Name2-(4-methyl-2,3-dihydroindol-1-yl)ethanol
PubChem CID131065584
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name2-(4-methyl-2,3-dihydroindol-1-yl)ethanol
SMILESCc1cccc2c1CCN2CCO
InChIInChI=1S/C11H15NO/c1-9-3-2-4-11-10(9)5-6-12(11)7-8-13/h2-4,13H,5-8H2,1H3
InChIKeyDKYGQSYBQIDRMO-UHFFFAOYSA-N
XLogP1.35
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-2,3-dihydroindol-1-yl)ethanol?
The IUPAC name of 2-(4-methyl-2,3-dihydroindol-1-yl)ethanol (CID 131065584) is 2-(4-methyl-2,3-dihydroindol-1-yl)ethanol.
What is the SMILES notation for 2-(4-methyl-2,3-dihydroindol-1-yl)ethanol?
The canonical SMILES for 2-(4-methyl-2,3-dihydroindol-1-yl)ethanol is Cc1cccc2c1CCN2CCO.
What is the InChIKey of 2-(4-methyl-2,3-dihydroindol-1-yl)ethanol?
The InChIKey is DKYGQSYBQIDRMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-9-3-2-4-11-10(9)5-6-12(11)7-8-13/h2-4,13H,5-8H2,1H3.
What are the key properties of 2-(4-methyl-2,3-dihydroindol-1-yl)ethanol?
2-(4-methyl-2,3-dihydroindol-1-yl)ethanol has a molecular weight of 177.25 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-2,3-dihydroindol-1-yl)ethanol is sourced from PubChem (CID 131065584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).