6-methylindol-6-ol

C9H9NO — CID 139827395

IUPAC6-methylindol-6-ol
SMILESCC1(O)C=CC2=CC=NC2=C1
InChIInChI=1S/C9H9NO/c1-9(11)4-2-7-3-5-10-8(7)6-9/h2-6,11H,1H3
InChIKeyMLGDYPLRGPFQEY-UHFFFAOYSA-N
MW147.18 g/mol
LogP1.20
Rot. Bonds

About 6-methylindol-6-ol

6-methylindol-6-ol (PubChem CID 139827395) has the molecular formula C9H9NO and a molecular weight of 147.18 g/mol. Its IUPAC name is 6-methylindol-6-ol.

Molecular Properties

Compound Name6-methylindol-6-ol
PubChem CID139827395
Molecular FormulaC9H9NO
Molecular Weight147.18 g/mol
Exact Mass147.07
IUPAC Name6-methylindol-6-ol
SMILESCC1(O)C=CC2=CC=NC2=C1
InChIInChI=1S/C9H9NO/c1-9(11)4-2-7-3-5-10-8(7)6-9/h2-6,11H,1H3
InChIKeyMLGDYPLRGPFQEY-UHFFFAOYSA-N
XLogP1.20
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methylindol-6-ol?
The IUPAC name of 6-methylindol-6-ol (CID 139827395) is 6-methylindol-6-ol.
What is the SMILES notation for 6-methylindol-6-ol?
The canonical SMILES for 6-methylindol-6-ol is CC1(O)C=CC2=CC=NC2=C1.
What is the InChIKey of 6-methylindol-6-ol?
The InChIKey is MLGDYPLRGPFQEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO/c1-9(11)4-2-7-3-5-10-8(7)6-9/h2-6,11H,1H3.
What are the key properties of 6-methylindol-6-ol?
6-methylindol-6-ol has a molecular weight of 147.18 g/mol, XLogP of 1.20, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylindol-6-ol is sourced from PubChem (CID 139827395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).