2-(2,4-difluorophenyl)isoindole

C14H9F2N — CID 19820193

IUPAC2-(2,4-difluorophenyl)isoindole
SMILESFc1ccc(-n2cc3ccccc3c2)c(F)c1
InChIInChI=1S/C14H9F2N/c15-12-5-6-14(13(16)7-12)17-8-10-3-1-2-4-11(10)9-17/h1-9H
InChIKeyUQCFHOVUQIQRKR-UHFFFAOYSA-N
MW229.23 g/mol
LogP3.91
Rot. Bonds1

About 2-(2,4-difluorophenyl)isoindole

2-(2,4-difluorophenyl)isoindole (PubChem CID 19820193) has the molecular formula C14H9F2N and a molecular weight of 229.23 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)isoindole.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)isoindole
PubChem CID19820193
Molecular FormulaC14H9F2N
Molecular Weight229.23 g/mol
Exact Mass229.07
IUPAC Name2-(2,4-difluorophenyl)isoindole
SMILESFc1ccc(-n2cc3ccccc3c2)c(F)c1
InChIInChI=1S/C14H9F2N/c15-12-5-6-14(13(16)7-12)17-8-10-3-1-2-4-11(10)9-17/h1-9H
InChIKeyUQCFHOVUQIQRKR-UHFFFAOYSA-N
XLogP3.91
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.23
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)isoindole?
The IUPAC name of 2-(2,4-difluorophenyl)isoindole (CID 19820193) is 2-(2,4-difluorophenyl)isoindole.
What is the SMILES notation for 2-(2,4-difluorophenyl)isoindole?
The canonical SMILES for 2-(2,4-difluorophenyl)isoindole is Fc1ccc(-n2cc3ccccc3c2)c(F)c1.
What is the InChIKey of 2-(2,4-difluorophenyl)isoindole?
The InChIKey is UQCFHOVUQIQRKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F2N/c15-12-5-6-14(13(16)7-12)17-8-10-3-1-2-4-11(10)9-17/h1-9H.
What are the key properties of 2-(2,4-difluorophenyl)isoindole?
2-(2,4-difluorophenyl)isoindole has a molecular weight of 229.23 g/mol, XLogP of 3.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)isoindole is sourced from PubChem (CID 19820193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).