2-(difluoromethyl)-6-fluoroindazole

C8H5F3N2 — CID 176929253

IUPAC2-(difluoromethyl)-6-fluoroindazole
SMILESFc1ccc2cn(C(F)F)nc2c1
InChIInChI=1S/C8H5F3N2/c9-6-2-1-5-4-13(8(10)11)12-7(5)3-6/h1-4,8H
InChIKeyLHFOYFFHPDFNKU-UHFFFAOYSA-N
MW186.14 g/mol
LogP2.57
Rot. Bonds1

About 2-(difluoromethyl)-6-fluoroindazole

2-(difluoromethyl)-6-fluoroindazole (PubChem CID 176929253) has the molecular formula C8H5F3N2 and a molecular weight of 186.14 g/mol. Its IUPAC name is 2-(difluoromethyl)-6-fluoroindazole.

Molecular Properties

Compound Name2-(difluoromethyl)-6-fluoroindazole
PubChem CID176929253
Molecular FormulaC8H5F3N2
Molecular Weight186.14 g/mol
Exact Mass186.04
IUPAC Name2-(difluoromethyl)-6-fluoroindazole
SMILESFc1ccc2cn(C(F)F)nc2c1
InChIInChI=1S/C8H5F3N2/c9-6-2-1-5-4-13(8(10)11)12-7(5)3-6/h1-4,8H
InChIKeyLHFOYFFHPDFNKU-UHFFFAOYSA-N
XLogP2.57
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.14
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-6-fluoroindazole?
The IUPAC name of 2-(difluoromethyl)-6-fluoroindazole (CID 176929253) is 2-(difluoromethyl)-6-fluoroindazole.
What is the SMILES notation for 2-(difluoromethyl)-6-fluoroindazole?
The canonical SMILES for 2-(difluoromethyl)-6-fluoroindazole is Fc1ccc2cn(C(F)F)nc2c1.
What is the InChIKey of 2-(difluoromethyl)-6-fluoroindazole?
The InChIKey is LHFOYFFHPDFNKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5F3N2/c9-6-2-1-5-4-13(8(10)11)12-7(5)3-6/h1-4,8H.
What are the key properties of 2-(difluoromethyl)-6-fluoroindazole?
2-(difluoromethyl)-6-fluoroindazole has a molecular weight of 186.14 g/mol, XLogP of 2.57, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-6-fluoroindazole is sourced from PubChem (CID 176929253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).