1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene

C15H11BrF2O — CID 23082875

IUPAC1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene
SMILESFc1cc(Br)cc(F)c1OC1CCc2ccccc21
InChIInChI=1S/C15H11BrF2O/c16-10-7-12(17)15(13(18)8-10)19-14-6-5-9-3-1-2-4-11(9)14/h1-4,7-8,14H,5-6H2
InChIKeyIPLNMOKZKGSGFZ-UHFFFAOYSA-N
MW325.15 g/mol
LogP4.79
Rot. Bonds2

About 1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene

1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene (PubChem CID 23082875) has the molecular formula C15H11BrF2O and a molecular weight of 325.15 g/mol. Its IUPAC name is 1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene
PubChem CID23082875
Molecular FormulaC15H11BrF2O
Molecular Weight325.15 g/mol
Exact Mass324.00
IUPAC Name1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene
SMILESFc1cc(Br)cc(F)c1OC1CCc2ccccc21
InChIInChI=1S/C15H11BrF2O/c16-10-7-12(17)15(13(18)8-10)19-14-6-5-9-3-1-2-4-11(9)14/h1-4,7-8,14H,5-6H2
InChIKeyIPLNMOKZKGSGFZ-UHFFFAOYSA-N
XLogP4.79
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.15
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene 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 1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene?
The IUPAC name of 1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene (CID 23082875) is 1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene.
What is the SMILES notation for 1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene?
The canonical SMILES for 1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene is Fc1cc(Br)cc(F)c1OC1CCc2ccccc21.
What is the InChIKey of 1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene?
The InChIKey is IPLNMOKZKGSGFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrF2O/c16-10-7-12(17)15(13(18)8-10)19-14-6-5-9-3-1-2-4-11(9)14/h1-4,7-8,14H,5-6H2.
What are the key properties of 1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene?
1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene has a molecular weight of 325.15 g/mol, XLogP of 4.79, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-bromo-2,6-difluorophenoxy)-2,3-dihydro-1H-indene is sourced from PubChem (CID 23082875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).