(5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole

C16H18N2 — CID 137390209

IUPAC(5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole
SMILESc1ccc2c(c1)-c1cncn1[C@H]2C1CCCCC1
InChIInChI=1S/C16H18N2/c1-2-6-12(7-3-1)16-14-9-5-4-8-13(14)15-10-17-11-18(15)16/h4-5,8-12,16H,1-3,6-7H2/t16-/m0/s1
InChIKeyZXUNUYPKRQCENX-INIZCTEOSA-N
MW238.33 g/mol
LogP4.03
Rot. Bonds1

About (5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole

(5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole (PubChem CID 137390209) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is (5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole.

Molecular Properties

Compound Name(5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole
PubChem CID137390209
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC Name(5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole
SMILESc1ccc2c(c1)-c1cncn1[C@H]2C1CCCCC1
InChIInChI=1S/C16H18N2/c1-2-6-12(7-3-1)16-14-9-5-4-8-13(14)15-10-17-11-18(15)16/h4-5,8-12,16H,1-3,6-7H2/t16-/m0/s1
InChIKeyZXUNUYPKRQCENX-INIZCTEOSA-N
XLogP4.03
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Osilodrostat
CID 44139752
1-benzyl-5-phenyl-1H-imidazole
CID 10444038
6-Phenyl-2,3-dihydroimidazo(2,1-b)thiazole
CID 432820
2,6-Diphenylimidazo[1,2-a]pyridine
CID 58880626
trans-4-((1R)-2-((5S)-6-Fluoro-5H-imidazo(5,1-a)isoindol-5-yl)-1-hydroxyethyl)cyclohexanol
CID 70914230
1-methyl-5-(2-naphthyl)-1H-imidazole
CID 11550235
Nlg919
CID 66558287
1-phenyl-2-(p-tolyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium bromide
CID 16682272
1-Methyl-5-phenyl-imidazol-2-amine
CID 1132927
2-Phenylimidazo[1,2-a]pyrimidine
CID 204149
1-Methyl-5-phenyl-1H-imidazole
CID 3746343
3,7-Diphenylimidazo[1,2-a]pyridine
CID 5329339

Frequently Asked Questions

What is the IUPAC name of (5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole?
The IUPAC name of (5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole (CID 137390209) is (5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole.
What is the SMILES notation for (5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole?
The canonical SMILES for (5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole is c1ccc2c(c1)-c1cncn1[C@H]2C1CCCCC1.
What is the InChIKey of (5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole?
The InChIKey is ZXUNUYPKRQCENX-INIZCTEOSA-N. The full InChI is InChI=1S/C16H18N2/c1-2-6-12(7-3-1)16-14-9-5-4-8-13(14)15-10-17-11-18(15)16/h4-5,8-12,16H,1-3,6-7H2/t16-/m0/s1.
What are the key properties of (5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole?
(5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole has a molecular weight of 238.33 g/mol, XLogP of 4.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-cyclohexyl-5H-imidazo[5,1-a]isoindole is sourced from PubChem (CID 137390209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).