1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole

C16H11FN2 — CID 21203132

IUPAC1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole
SMILESFc1ccc(-c2ncn3c2-c2ccccc2C3)cc1
InChIInChI=1S/C16H11FN2/c17-13-7-5-11(6-8-13)15-16-14-4-2-1-3-12(14)9-19(16)10-18-15/h1-8,10H,9H2
InChIKeyZNWYFOJNBFEZAK-UHFFFAOYSA-N
MW250.28 g/mol
LogP3.72
Rot. Bonds1

About 1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole

1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole (PubChem CID 21203132) has the molecular formula C16H11FN2 and a molecular weight of 250.28 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole.

Molecular Properties

Compound Name1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole
PubChem CID21203132
Molecular FormulaC16H11FN2
Molecular Weight250.28 g/mol
Exact Mass250.09
IUPAC Name1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole
SMILESFc1ccc(-c2ncn3c2-c2ccccc2C3)cc1
InChIInChI=1S/C16H11FN2/c17-13-7-5-11(6-8-13)15-16-14-4-2-1-3-12(14)9-19(16)10-18-15/h1-8,10H,9H2
InChIKeyZNWYFOJNBFEZAK-UHFFFAOYSA-N
XLogP3.72
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole?
The IUPAC name of 1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole (CID 21203132) is 1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole.
What is the SMILES notation for 1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole?
The canonical SMILES for 1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole is Fc1ccc(-c2ncn3c2-c2ccccc2C3)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole?
The InChIKey is ZNWYFOJNBFEZAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN2/c17-13-7-5-11(6-8-13)15-16-14-4-2-1-3-12(14)9-19(16)10-18-15/h1-8,10H,9H2.
What are the key properties of 1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole?
1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole has a molecular weight of 250.28 g/mol, XLogP of 3.72, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-5H-imidazo[5,1-a]isoindole is sourced from PubChem (CID 21203132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).