indol-3a-ol

C8H7NO — CID 163203728

IUPACindol-3a-ol
SMILESOC12C=CC=CC1=NC=C2
InChIInChI=1S/C8H7NO/c10-8-4-2-1-3-7(8)9-6-5-8/h1-6,10H
InChIKeyJLHQLHGFTMKUIW-UHFFFAOYSA-N
MW133.15 g/mol
LogP0.81
Rot. Bonds

About indol-3a-ol

indol-3a-ol (PubChem CID 163203728) has the molecular formula C8H7NO and a molecular weight of 133.15 g/mol. Its IUPAC name is indol-3a-ol.

Molecular Properties

Compound Nameindol-3a-ol
PubChem CID163203728
Molecular FormulaC8H7NO
Molecular Weight133.15 g/mol
Exact Mass133.05
IUPAC Nameindol-3a-ol
SMILESOC12C=CC=CC1=NC=C2
InChIInChI=1S/C8H7NO/c10-8-4-2-1-3-7(8)9-6-5-8/h1-6,10H
InChIKeyJLHQLHGFTMKUIW-UHFFFAOYSA-N
XLogP0.81
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of indol-3a-ol?
The IUPAC name of indol-3a-ol (CID 163203728) is indol-3a-ol.
What is the SMILES notation for indol-3a-ol?
The canonical SMILES for indol-3a-ol is OC12C=CC=CC1=NC=C2.
What is the InChIKey of indol-3a-ol?
The InChIKey is JLHQLHGFTMKUIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NO/c10-8-4-2-1-3-7(8)9-6-5-8/h1-6,10H.
What are the key properties of indol-3a-ol?
indol-3a-ol has a molecular weight of 133.15 g/mol, XLogP of 0.81, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for indol-3a-ol is sourced from PubChem (CID 163203728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).