3-methyl-1,2-dihydroindol-3-ol

C9H11NO — CID 67373673

IUPAC3-methyl-1,2-dihydroindol-3-ol
SMILESCC1(O)CNc2ccccc21
InChIInChI=1S/C9H11NO/c1-9(11)6-10-8-5-3-2-4-7(8)9/h2-5,10-11H,6H2,1H3
InChIKeyBDLKFNQHXGFODU-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.32
Rot. Bonds

About 3-methyl-1,2-dihydroindol-3-ol

3-methyl-1,2-dihydroindol-3-ol (PubChem CID 67373673) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 3-methyl-1,2-dihydroindol-3-ol.

Molecular Properties

Compound Name3-methyl-1,2-dihydroindol-3-ol
PubChem CID67373673
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name3-methyl-1,2-dihydroindol-3-ol
SMILESCC1(O)CNc2ccccc21
InChIInChI=1S/C9H11NO/c1-9(11)6-10-8-5-3-2-4-7(8)9/h2-5,10-11H,6H2,1H3
InChIKeyBDLKFNQHXGFODU-UHFFFAOYSA-N
XLogP1.32
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1,2-dihydroindol-3-ol?
The IUPAC name of 3-methyl-1,2-dihydroindol-3-ol (CID 67373673) is 3-methyl-1,2-dihydroindol-3-ol.
What is the SMILES notation for 3-methyl-1,2-dihydroindol-3-ol?
The canonical SMILES for 3-methyl-1,2-dihydroindol-3-ol is CC1(O)CNc2ccccc21.
What is the InChIKey of 3-methyl-1,2-dihydroindol-3-ol?
The InChIKey is BDLKFNQHXGFODU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-9(11)6-10-8-5-3-2-4-7(8)9/h2-5,10-11H,6H2,1H3.
What are the key properties of 3-methyl-1,2-dihydroindol-3-ol?
3-methyl-1,2-dihydroindol-3-ol has a molecular weight of 149.19 g/mol, XLogP of 1.32, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1,2-dihydroindol-3-ol is sourced from PubChem (CID 67373673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).