6-phenylimidazo[2,1-a]isoquinoline

C17H12N2 — CID 58517625

IUPAC6-phenylimidazo[2,1-a]isoquinoline
SMILESc1ccc(-c2cn3ccnc3c3ccccc23)cc1
InChIInChI=1S/C17H12N2/c1-2-6-13(7-3-1)16-12-19-11-10-18-17(19)15-9-5-4-8-14(15)16/h1-12H
InChIKeyJDGIOQWHZUHGKR-UHFFFAOYSA-N
MW244.30 g/mol
LogP4.15
Rot. Bonds1

About 6-phenylimidazo[2,1-a]isoquinoline

6-phenylimidazo[2,1-a]isoquinoline (PubChem CID 58517625) has the molecular formula C17H12N2 and a molecular weight of 244.30 g/mol. Its IUPAC name is 6-phenylimidazo[2,1-a]isoquinoline.

Molecular Properties

Compound Name6-phenylimidazo[2,1-a]isoquinoline
PubChem CID58517625
Molecular FormulaC17H12N2
Molecular Weight244.30 g/mol
Exact Mass244.10
IUPAC Name6-phenylimidazo[2,1-a]isoquinoline
SMILESc1ccc(-c2cn3ccnc3c3ccccc23)cc1
InChIInChI=1S/C17H12N2/c1-2-6-13(7-3-1)16-12-19-11-10-18-17(19)15-9-5-4-8-14(15)16/h1-12H
InChIKeyJDGIOQWHZUHGKR-UHFFFAOYSA-N
XLogP4.15
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-tert-butylimidazo[2,1-a]isoquinoline
CID 58518039
9-phenylimidazo[1,2-f]phenanthridine
CID 59358454
7-(4-carbazol-9-ylphenyl)imidazo[2,1-a]isoquinoline
CID 58517577
4,5-diphenylimidazo[1,2-a]quinoline
CID 135058439
hydron;imidazo[1,2-c]quinazoline
CID 174874267
N-methyl-6-phenylimidazo[1,2-a]pyrazin-8-amine
CID 21070891
7-chloroimidazo[2,1-a]isoquinoline
CID 58517958
6-(5-methyl-1-phenylpyrazol-4-yl)-8-phenylimidazo[1,2-a]pyridine
CID 58207977
10-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,6,10-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11,13,15-heptaene
CID 149444858
8-(4-imidazo[2,1-a]isoquinolin-7-ylphenyl)-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58517960
7-quinolin-8-ylimidazo[2,1-a]isoquinoline
CID 58517751
8-phenyl-2-[4-[10-[4-(8-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]anthracen-9-yl]phenyl]imidazo[1,2-a]pyridine
CID 89089682

Frequently Asked Questions

What is the IUPAC name of 6-phenylimidazo[2,1-a]isoquinoline?
The IUPAC name of 6-phenylimidazo[2,1-a]isoquinoline (CID 58517625) is 6-phenylimidazo[2,1-a]isoquinoline.
What is the SMILES notation for 6-phenylimidazo[2,1-a]isoquinoline?
The canonical SMILES for 6-phenylimidazo[2,1-a]isoquinoline is c1ccc(-c2cn3ccnc3c3ccccc23)cc1.
What is the InChIKey of 6-phenylimidazo[2,1-a]isoquinoline?
The InChIKey is JDGIOQWHZUHGKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2/c1-2-6-13(7-3-1)16-12-19-11-10-18-17(19)15-9-5-4-8-14(15)16/h1-12H.
What are the key properties of 6-phenylimidazo[2,1-a]isoquinoline?
6-phenylimidazo[2,1-a]isoquinoline has a molecular weight of 244.30 g/mol, XLogP of 4.15, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenylimidazo[2,1-a]isoquinoline is sourced from PubChem (CID 58517625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).