3,3-difluoro-1,2-dihydroindol-2-ol

C8H7F2NO — CID 156630733

IUPAC3,3-difluoro-1,2-dihydroindol-2-ol
SMILESOC1Nc2ccccc2C1(F)F
InChIInChI=1S/C8H7F2NO/c9-8(10)5-3-1-2-4-6(5)11-7(8)12/h1-4,7,11-12H
InChIKeyCTMODJQZGBOWGL-UHFFFAOYSA-N
MW171.15 g/mol
LogP1.52
Rot. Bonds

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

3,3-difluoro-1,2-dihydroindol-2-ol (PubChem CID 156630733) has the molecular formula C8H7F2NO and a molecular weight of 171.15 g/mol. Its IUPAC name is 3,3-difluoro-1,2-dihydroindol-2-ol.

Molecular Properties

Compound Name3,3-difluoro-1,2-dihydroindol-2-ol
PubChem CID156630733
Molecular FormulaC8H7F2NO
Molecular Weight171.15 g/mol
Exact Mass171.05
IUPAC Name3,3-difluoro-1,2-dihydroindol-2-ol
SMILESOC1Nc2ccccc2C1(F)F
InChIInChI=1S/C8H7F2NO/c9-8(10)5-3-1-2-4-6(5)11-7(8)12/h1-4,7,11-12H
InChIKeyCTMODJQZGBOWGL-UHFFFAOYSA-N
XLogP1.52
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.15
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3,3-difluoro-1,2-dihydroindol-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-1,2-dihydroindol-2-ol?
The IUPAC name of 3,3-difluoro-1,2-dihydroindol-2-ol (CID 156630733) is 3,3-difluoro-1,2-dihydroindol-2-ol.
What is the SMILES notation for 3,3-difluoro-1,2-dihydroindol-2-ol?
The canonical SMILES for 3,3-difluoro-1,2-dihydroindol-2-ol is OC1Nc2ccccc2C1(F)F.
What is the InChIKey of 3,3-difluoro-1,2-dihydroindol-2-ol?
The InChIKey is CTMODJQZGBOWGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F2NO/c9-8(10)5-3-1-2-4-6(5)11-7(8)12/h1-4,7,11-12H.
What are the key properties of 3,3-difluoro-1,2-dihydroindol-2-ol?
3,3-difluoro-1,2-dihydroindol-2-ol has a molecular weight of 171.15 g/mol, XLogP of 1.52, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-1,2-dihydroindol-2-ol is sourced from PubChem (CID 156630733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).