2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline

C18H14N2O — CID 746061

IUPAC2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline
SMILESCOc1ccc(-c2cn3ccc4ccccc4c3n2)cc1
InChIInChI=1S/C18H14N2O/c1-21-15-8-6-14(7-9-15)17-12-20-11-10-13-4-2-3-5-16(13)18(20)19-17/h2-12H,1H3
InChIKeyZYWYGWRRHDDHSN-UHFFFAOYSA-N
MW274.32 g/mol
LogP4.16
Rot. Bonds2

About 2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline

2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline (PubChem CID 746061) has the molecular formula C18H14N2O and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline.

Molecular Properties

Compound Name2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline
PubChem CID746061
Molecular FormulaC18H14N2O
Molecular Weight274.32 g/mol
Exact Mass274.11
IUPAC Name2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline
SMILESCOc1ccc(-c2cn3ccc4ccccc4c3n2)cc1
InChIInChI=1S/C18H14N2O/c1-21-15-8-6-14(7-9-15)17-12-20-11-10-13-4-2-3-5-16(13)18(20)19-17/h2-12H,1H3
InChIKeyZYWYGWRRHDDHSN-UHFFFAOYSA-N
XLogP4.16
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-Methyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 146659124
Metodesnitazene
CID 26412
7-butyl-6-(4-methoxyphenyl)-5H-pyrrolo[2,3-b]pyrazine
CID 3641059
1-(4-methoxybenzyl)-2-(4-methoxyphenyl)-1H-benzo(d)imidazole
CID 746182
2-(4-Methoxyphenyl)imidazo[1,2-a]pyridine
CID 694963
2-(4-Ethoxyphenyl)imidazo[1,2-a]pyridine
CID 720519
2-(4-Propoxyphenyl)imidazo[1,2-a]pyridine
CID 2876085
5-(4-methoxyphenyl)-1-methyl-1H-imidazol-2-amine
CID 1132944
5-(4-Methoxyphenyl)-2-phenyl-1H-imidazole
CID 12024852
3-(6-Methoxypyridin-2-yl)-7-phenylimidazo[1,2-a]pyridine
CID 5329342
1-[2-(4-{3-phenyl-3H-imidazo[4,5-b]pyridin-6-yl}phenoxy)ethyl]piperidine
CID 5329413
2,4-Disubstituted Pyrimidine 2f
CID 5329419

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline?
The IUPAC name of 2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline (CID 746061) is 2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline.
What is the SMILES notation for 2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline?
The canonical SMILES for 2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline is COc1ccc(-c2cn3ccc4ccccc4c3n2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline?
The InChIKey is ZYWYGWRRHDDHSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O/c1-21-15-8-6-14(7-9-15)17-12-20-11-10-13-4-2-3-5-16(13)18(20)19-17/h2-12H,1H3.
What are the key properties of 2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline?
2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline has a molecular weight of 274.32 g/mol, XLogP of 4.16, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)imidazo[2,1-a]isoquinoline is sourced from PubChem (CID 746061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).