1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one

C24H21FN2O — CID 59025933

IUPAC1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one
SMILESCc1ccc(C23c4ccccc4C(=O)N2CCN3Cc2ccc(F)cc2)cc1
InChIInChI=1S/C24H21FN2O/c1-17-6-10-19(11-7-17)24-22-5-3-2-4-21(22)23(28)27(24)15-14-26(24)16-18-8-12-20(25)13-9-18/h2-13H,14-16H2,1H3
InChIKeyRIGGVMVSPPFAOQ-UHFFFAOYSA-N
MW372.44 g/mol
LogP4.31
Rot. Bonds3

About 1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one

1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one (PubChem CID 59025933) has the molecular formula C24H21FN2O and a molecular weight of 372.44 g/mol. Its IUPAC name is 1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one.

Molecular Properties

Compound Name1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one
PubChem CID59025933
Molecular FormulaC24H21FN2O
Molecular Weight372.44 g/mol
Exact Mass372.16
IUPAC Name1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one
SMILESCc1ccc(C23c4ccccc4C(=O)N2CCN3Cc2ccc(F)cc2)cc1
InChIInChI=1S/C24H21FN2O/c1-17-6-10-19(11-7-17)24-22-5-3-2-4-21(22)23(28)27(24)15-14-26(24)16-18-8-12-20(25)13-9-18/h2-13H,14-16H2,1H3
InChIKeyRIGGVMVSPPFAOQ-UHFFFAOYSA-N
XLogP4.31
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.44
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one 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 1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one?
The IUPAC name of 1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one (CID 59025933) is 1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one.
What is the SMILES notation for 1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one?
The canonical SMILES for 1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one is Cc1ccc(C23c4ccccc4C(=O)N2CCN3Cc2ccc(F)cc2)cc1.
What is the InChIKey of 1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one?
The InChIKey is RIGGVMVSPPFAOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21FN2O/c1-17-6-10-19(11-7-17)24-22-5-3-2-4-21(22)23(28)27(24)15-14-26(24)16-18-8-12-20(25)13-9-18/h2-13H,14-16H2,1H3.
What are the key properties of 1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one?
1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one has a molecular weight of 372.44 g/mol, XLogP of 4.31, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one is sourced from PubChem (CID 59025933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).