3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol

C11H11F2NO — CID 175334423

IUPAC3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol
SMILESOC1(C(F)C=CF)CNc2ccccc21
InChIInChI=1S/C11H11F2NO/c12-6-5-10(13)11(15)7-14-9-4-2-1-3-8(9)11/h1-6,10,14-15H,7H2
InChIKeyQFPMLDWDOLCCSX-UHFFFAOYSA-N
MW211.21 g/mol
LogP2.12
Rot. Bonds2

About 3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol

3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol (PubChem CID 175334423) has the molecular formula C11H11F2NO and a molecular weight of 211.21 g/mol. Its IUPAC name is 3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol.

Molecular Properties

Compound Name3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol
PubChem CID175334423
Molecular FormulaC11H11F2NO
Molecular Weight211.21 g/mol
Exact Mass211.08
IUPAC Name3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol
SMILESOC1(C(F)C=CF)CNc2ccccc21
InChIInChI=1S/C11H11F2NO/c12-6-5-10(13)11(15)7-14-9-4-2-1-3-8(9)11/h1-6,10,14-15H,7H2
InChIKeyQFPMLDWDOLCCSX-UHFFFAOYSA-N
XLogP2.12
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.21
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol?
The IUPAC name of 3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol (CID 175334423) is 3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol.
What is the SMILES notation for 3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol?
The canonical SMILES for 3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol is OC1(C(F)C=CF)CNc2ccccc21.
What is the InChIKey of 3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol?
The InChIKey is QFPMLDWDOLCCSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F2NO/c12-6-5-10(13)11(15)7-14-9-4-2-1-3-8(9)11/h1-6,10,14-15H,7H2.
What are the key properties of 3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol?
3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol has a molecular weight of 211.21 g/mol, XLogP of 2.12, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3-difluoroprop-2-enyl)-1,2-dihydroindol-3-ol is sourced from PubChem (CID 175334423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).