8-fluoro-5H-imidazo[5,1-a]isoindole

C10H7FN2 — CID 118704528

IUPAC8-fluoro-5H-imidazo[5,1-a]isoindole
SMILESFc1ccc2c(c1)-c1cncn1C2
InChIInChI=1S/C10H7FN2/c11-8-2-1-7-5-13-6-12-4-10(13)9(7)3-8/h1-4,6H,5H2
InChIKeySFWMMCAUXNGTQU-UHFFFAOYSA-N
MW174.18 g/mol
LogP2.05
Rot. Bonds

About 8-fluoro-5H-imidazo[5,1-a]isoindole

8-fluoro-5H-imidazo[5,1-a]isoindole (PubChem CID 118704528) has the molecular formula C10H7FN2 and a molecular weight of 174.18 g/mol. Its IUPAC name is 8-fluoro-5H-imidazo[5,1-a]isoindole.

Molecular Properties

Compound Name8-fluoro-5H-imidazo[5,1-a]isoindole
PubChem CID118704528
Molecular FormulaC10H7FN2
Molecular Weight174.18 g/mol
Exact Mass174.06
IUPAC Name8-fluoro-5H-imidazo[5,1-a]isoindole
SMILESFc1ccc2c(c1)-c1cncn1C2
InChIInChI=1S/C10H7FN2/c11-8-2-1-7-5-13-6-12-4-10(13)9(7)3-8/h1-4,6H,5H2
InChIKeySFWMMCAUXNGTQU-UHFFFAOYSA-N
XLogP2.05
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.18
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-5H-imidazo[5,1-a]isoindole?
The IUPAC name of 8-fluoro-5H-imidazo[5,1-a]isoindole (CID 118704528) is 8-fluoro-5H-imidazo[5,1-a]isoindole.
What is the SMILES notation for 8-fluoro-5H-imidazo[5,1-a]isoindole?
The canonical SMILES for 8-fluoro-5H-imidazo[5,1-a]isoindole is Fc1ccc2c(c1)-c1cncn1C2.
What is the InChIKey of 8-fluoro-5H-imidazo[5,1-a]isoindole?
The InChIKey is SFWMMCAUXNGTQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN2/c11-8-2-1-7-5-13-6-12-4-10(13)9(7)3-8/h1-4,6H,5H2.
What are the key properties of 8-fluoro-5H-imidazo[5,1-a]isoindole?
8-fluoro-5H-imidazo[5,1-a]isoindole has a molecular weight of 174.18 g/mol, XLogP of 2.05, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-5H-imidazo[5,1-a]isoindole is sourced from PubChem (CID 118704528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).