7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol

C19H17N3O — CID 129296165

IUPAC7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol
SMILESOC1c2ncccc2CCC1C1c2ccccc2-c2cncn21
InChIInChI=1S/C19H17N3O/c23-19-15(8-7-12-4-3-9-21-17(12)19)18-14-6-2-1-5-13(14)16-10-20-11-22(16)18/h1-6,9-11,15,18-19,23H,7-8H2
InChIKeyNUHDYLFGQFGYLE-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.14
Rot. Bonds1

About 7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol

7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol (PubChem CID 129296165) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is 7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol.

Molecular Properties

Compound Name7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol
PubChem CID129296165
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC Name7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol
SMILESOC1c2ncccc2CCC1C1c2ccccc2-c2cncn21
InChIInChI=1S/C19H17N3O/c23-19-15(8-7-12-4-3-9-21-17(12)19)18-14-6-2-1-5-13(14)16-10-20-11-22(16)18/h1-6,9-11,15,18-19,23H,7-8H2
InChIKeyNUHDYLFGQFGYLE-UHFFFAOYSA-N
XLogP3.14
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol?
The IUPAC name of 7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol (CID 129296165) is 7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol.
What is the SMILES notation for 7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol?
The canonical SMILES for 7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol is OC1c2ncccc2CCC1C1c2ccccc2-c2cncn21.
What is the InChIKey of 7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol?
The InChIKey is NUHDYLFGQFGYLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c23-19-15(8-7-12-4-3-9-21-17(12)19)18-14-6-2-1-5-13(14)16-10-20-11-22(16)18/h1-6,9-11,15,18-19,23H,7-8H2.
What are the key properties of 7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol?
7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol has a molecular weight of 303.37 g/mol, XLogP of 3.14, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(5H-imidazo[5,1-a]isoindol-5-yl)-5,6,7,8-tetrahydroquinolin-8-ol is sourced from PubChem (CID 129296165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).