2-(1H-indol-3-yl)ethanol

C10H11NO — CID 10685

IUPAC2-(1H-indol-3-yl)ethanol
SMILESOCCc1c[nH]c2ccccc12
InChIInChI=1S/C10H11NO/c12-6-5-8-7-11-10-4-2-1-3-9(8)10/h1-4,7,11-12H,5-6H2
InChIKeyMBBOMCVGYCRMEA-UHFFFAOYSA-N
MW161.20 g/mol
LogP1.70
Rot. Bonds2

About 2-(1H-indol-3-yl)ethanol

2-(1H-indol-3-yl)ethanol (PubChem CID 10685) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)ethanol.

Molecular Properties

Compound Name2-(1H-indol-3-yl)ethanol
PubChem CID10685
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name2-(1H-indol-3-yl)ethanol
SMILESOCCc1c[nH]c2ccccc12
InChIInChI=1S/C10H11NO/c12-6-5-8-7-11-10-4-2-1-3-9(8)10/h1-4,7,11-12H,5-6H2
InChIKeyMBBOMCVGYCRMEA-UHFFFAOYSA-N
XLogP1.70
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)ethanol?
The IUPAC name of 2-(1H-indol-3-yl)ethanol (CID 10685) is 2-(1H-indol-3-yl)ethanol.
What is the SMILES notation for 2-(1H-indol-3-yl)ethanol?
The canonical SMILES for 2-(1H-indol-3-yl)ethanol is OCCc1c[nH]c2ccccc12.
What is the InChIKey of 2-(1H-indol-3-yl)ethanol?
The InChIKey is MBBOMCVGYCRMEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c12-6-5-8-7-11-10-4-2-1-3-9(8)10/h1-4,7,11-12H,5-6H2.
What are the key properties of 2-(1H-indol-3-yl)ethanol?
2-(1H-indol-3-yl)ethanol has a molecular weight of 161.20 g/mol, XLogP of 1.70, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)ethanol is sourced from PubChem (CID 10685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).