2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol

C80H85F5N10O5 — CID 157315168

IUPAC2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol
SMILESOC1CCCCC1C1c2ccc(F)cc2-c2cncn21.O[C@@H]1CCCC[C@H]1[C@@H]1c2ccc(F)cc2-c2cncn21.O[C@@H]1CCCC[C@H]1[C@H]1c2ccc(F)cc2-c2cncn21.O[C@H]1CCCC[C@@H]1[C@@H]1c2ccc(F)cc2-c2cncn21.O[C@H]1CCCC[C@@H]1[C@H]1c2ccc(F)cc2-c2cncn21
InChIInChI=1S/5C16H17FN2O/c5*17-10-5-6-11-13(7-10)14-8-18-9-19(14)16(11)12-3-1-2-4-15(12)20/h5*5-9,12,15-16,20H,1-4H2/t2*12-,15-,16+;2*12-,15-,16-;/m1010./s1
InChIKeyBDMUPJDKOSZZMC-TZMXXJJMSA-N
MW1361.61 g/mol
LogP15.72
Rot. Bonds5

About 2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol

2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol (PubChem CID 157315168) has the molecular formula C80H85F5N10O5 and a molecular weight of 1361.61 g/mol. Its IUPAC name is 2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol
PubChem CID157315168
Molecular FormulaC80H85F5N10O5
Molecular Weight1361.61 g/mol
Exact Mass1360.66
IUPAC Name2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol
SMILESOC1CCCCC1C1c2ccc(F)cc2-c2cncn21.O[C@@H]1CCCC[C@H]1[C@@H]1c2ccc(F)cc2-c2cncn21.O[C@@H]1CCCC[C@H]1[C@H]1c2ccc(F)cc2-c2cncn21.O[C@H]1CCCC[C@@H]1[C@@H]1c2ccc(F)cc2-c2cncn21.O[C@H]1CCCC[C@@H]1[C@H]1c2ccc(F)cc2-c2cncn21
InChIInChI=1S/5C16H17FN2O/c5*17-10-5-6-11-13(7-10)14-8-18-9-19(14)16(11)12-3-1-2-4-15(12)20/h5*5-9,12,15-16,20H,1-4H2/t2*12-,15-,16+;2*12-,15-,16-;/m1010./s1
InChIKeyBDMUPJDKOSZZMC-TZMXXJJMSA-N
XLogP15.72
TPSA190.25 Ų
H-Bond Donors5
H-Bond Acceptors15
Rotatable Bonds5
Heavy Atoms100
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001361.61
LogP ≤ 515.72
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1015

Analyze 2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol with MolForge

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Related Compounds

1-(1-adamantyl)-2-(6-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)ethanol
CID 122498731
1-(1-adamantyl)-2-(9-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)ethanol
CID 122499140
1-(1-adamantyl)-2-(7-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)ethanol
CID 122499153
3-[2-(6-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)-1-hydroxyethyl]adamantan-1-ol
CID 122628156
5-[(1R)-2-(6-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)-1-hydroxyethyl]adamantan-2-ol
CID 138962011
5-[(1S)-2-(6-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)-1-hydroxyethyl]adamantan-2-ol
CID 138962012
3-[2-[(5R)-6-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]-1-hydroxyethyl]adamantan-1-ol
CID 146676836
3-[2-[(5S)-6-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]-1-hydroxyethyl]adamantan-1-ol
CID 146676837
Imidazoleisoindoles derivative 2
CID 122498962
4-Fluoro-1-[4-[1-fluoro-2-(4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)ethyl]-1-hydroxycyclohexyl]-4-[2-(4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)ethyl]cyclohexan-1-ol
CID 118917061
1,2-bis[4-fluoro-4-[2-(6-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)ethyl]cyclohexyl]ethane-1,2-diol
CID 118938900
1,2-bis[4-[2-(6-chloro-5H-imidazo[5,1-a]isoindol-5-yl)ethyl]-4-fluorocyclohexyl]ethane-1,2-diol
CID 118938901

Frequently Asked Questions

What is the IUPAC name of 2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol?
The IUPAC name of 2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol (CID 157315168) is 2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol.
What is the SMILES notation for 2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol?
The canonical SMILES for 2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol is OC1CCCCC1C1c2ccc(F)cc2-c2cncn21.O[C@@H]1CCCC[C@H]1[C@@H]1c2ccc(F)cc2-c2cncn21.O[C@@H]1CCCC[C@H]1[C@H]1c2ccc(F)cc2-c2cncn21.O[C@H]1CCCC[C@@H]1[C@@H]1c2ccc(F)cc2-c2cncn21.O[C@H]1CCCC[C@@H]1[C@H]1c2ccc(F)cc2-c2cncn21.
What is the InChIKey of 2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol?
The InChIKey is BDMUPJDKOSZZMC-TZMXXJJMSA-N. The full InChI is InChI=1S/5C16H17FN2O/c5*17-10-5-6-11-13(7-10)14-8-18-9-19(14)16(11)12-3-1-2-4-15(12)20/h5*5-9,12,15-16,20H,1-4H2/t2*12-,15-,16+;2*12-,15-,16-;/m1010./s1.
What are the key properties of 2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol?
2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol has a molecular weight of 1361.61 g/mol, XLogP of 15.72, 5 rotatable bonds, 5 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)cyclohexan-1-ol;trans-(1S,2R)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1S,2R)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5S)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol;trans-(1R,2S)-2-[(5R)-8-fluoro-5H-imidazo[5,1-a]isoindol-5-yl]cyclohexan-1-ol is sourced from PubChem (CID 157315168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).