2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole

C13H11FN2 — CID 100759722

IUPAC2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole
SMILESFc1ccc(N2Cc3ccccc3C2)nc1
InChIInChI=1S/C13H11FN2/c14-12-5-6-13(15-7-12)16-8-10-3-1-2-4-11(10)9-16/h1-7H,8-9H2
InChIKeyXAMUFHUIGSSNJT-UHFFFAOYSA-N
MW214.24 g/mol
LogP2.74
Rot. Bonds1

About 2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole

2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole (PubChem CID 100759722) has the molecular formula C13H11FN2 and a molecular weight of 214.24 g/mol. Its IUPAC name is 2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole.

Molecular Properties

Compound Name2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole
PubChem CID100759722
Molecular FormulaC13H11FN2
Molecular Weight214.24 g/mol
Exact Mass214.09
IUPAC Name2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole
SMILESFc1ccc(N2Cc3ccccc3C2)nc1
InChIInChI=1S/C13H11FN2/c14-12-5-6-13(15-7-12)16-8-10-3-1-2-4-11(10)9-16/h1-7H,8-9H2
InChIKeyXAMUFHUIGSSNJT-UHFFFAOYSA-N
XLogP2.74
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.24
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole 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 2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole?
The IUPAC name of 2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole (CID 100759722) is 2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole.
What is the SMILES notation for 2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole?
The canonical SMILES for 2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole is Fc1ccc(N2Cc3ccccc3C2)nc1.
What is the InChIKey of 2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole?
The InChIKey is XAMUFHUIGSSNJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2/c14-12-5-6-13(15-7-12)16-8-10-3-1-2-4-11(10)9-16/h1-7H,8-9H2.
What are the key properties of 2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole?
2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole has a molecular weight of 214.24 g/mol, XLogP of 2.74, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-pyridinyl)-1,3-dihydroisoindole is sourced from PubChem (CID 100759722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).