1-(1-methylindol-5-yl)ethanol

C11H13NO — CID 83387761

IUPAC1-(1-methylindol-5-yl)ethanol
SMILESCC(O)c1ccc2c(ccn2C)c1
InChIInChI=1S/C11H13NO/c1-8(13)9-3-4-11-10(7-9)5-6-12(11)2/h3-8,13H,1-2H3
InChIKeyJROSWOBSNNOUGA-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.23
Rot. Bonds1

About 1-(1-methylindol-5-yl)ethanol

1-(1-methylindol-5-yl)ethanol (PubChem CID 83387761) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is 1-(1-methylindol-5-yl)ethanol.

Molecular Properties

Compound Name1-(1-methylindol-5-yl)ethanol
PubChem CID83387761
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name1-(1-methylindol-5-yl)ethanol
SMILESCC(O)c1ccc2c(ccn2C)c1
InChIInChI=1S/C11H13NO/c1-8(13)9-3-4-11-10(7-9)5-6-12(11)2/h3-8,13H,1-2H3
InChIKeyJROSWOBSNNOUGA-UHFFFAOYSA-N
XLogP2.23
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylindol-5-yl)ethanol?
The IUPAC name of 1-(1-methylindol-5-yl)ethanol (CID 83387761) is 1-(1-methylindol-5-yl)ethanol.
What is the SMILES notation for 1-(1-methylindol-5-yl)ethanol?
The canonical SMILES for 1-(1-methylindol-5-yl)ethanol is CC(O)c1ccc2c(ccn2C)c1.
What is the InChIKey of 1-(1-methylindol-5-yl)ethanol?
The InChIKey is JROSWOBSNNOUGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-8(13)9-3-4-11-10(7-9)5-6-12(11)2/h3-8,13H,1-2H3.
What are the key properties of 1-(1-methylindol-5-yl)ethanol?
1-(1-methylindol-5-yl)ethanol has a molecular weight of 175.23 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylindol-5-yl)ethanol is sourced from PubChem (CID 83387761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).