2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline

C17H11ClN2 — CID 13156067

IUPAC2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline
SMILESClc1cccc(-c2cn3ccc4ccccc4c3n2)c1
InChIInChI=1S/C17H11ClN2/c18-14-6-3-5-13(10-14)16-11-20-9-8-12-4-1-2-7-15(12)17(20)19-16/h1-11H
InChIKeyFRCIBYDYVXQXGC-UHFFFAOYSA-N
MW278.74 g/mol
LogP4.81
Rot. Bonds1

About 2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline

2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline (PubChem CID 13156067) has the molecular formula C17H11ClN2 and a molecular weight of 278.74 g/mol. Its IUPAC name is 2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline.

Molecular Properties

Compound Name2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline
PubChem CID13156067
Molecular FormulaC17H11ClN2
Molecular Weight278.74 g/mol
Exact Mass278.06
IUPAC Name2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline
SMILESClc1cccc(-c2cn3ccc4ccccc4c3n2)c1
InChIInChI=1S/C17H11ClN2/c18-14-6-3-5-13(10-14)16-11-20-9-8-12-4-1-2-7-15(12)17(20)19-16/h1-11H
InChIKeyFRCIBYDYVXQXGC-UHFFFAOYSA-N
XLogP4.81
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)imidazo[1,2-a]pyrimidin-7-amine
CID 67388301
2-(2-fluorophenyl)imidazo[2,1-a]isoquinoline
CID 138975222
7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one
CID 53036431
1-benzyl-4-(3-chlorophenyl)-2-(4-chlorophenyl)imidazole
CID 163216978
2-(3-bromophenyl)-7-chloroimidazo[1,2-a]pyridine
CID 117128097
5-bromo-2-(3-chlorophenyl)imidazo[1,2-a]pyridine
CID 117133012
(8-chloroimidazo[2,1-a]isoquinolin-2-yl)methanamine
CID 115038584
7-chloro-2-(4-phenylphenyl)imidazo[1,2-a]pyridine bromide
CID 21203031
6-(3-chlorophenyl)-8-(4-pyridin-4-ylpiperazin-1-yl)imidazo[1,2-a]pyrazine
CID 45488436
2-(3-chlorophenyl)-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine
CID 171469861
8-bromo-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine
CID 113303446
5-(3-chlorophenyl)-1-hydroxy-3-phenylpyrazin-2-one
CID 1486226

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline?
The IUPAC name of 2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline (CID 13156067) is 2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline.
What is the SMILES notation for 2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline?
The canonical SMILES for 2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline is Clc1cccc(-c2cn3ccc4ccccc4c3n2)c1.
What is the InChIKey of 2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline?
The InChIKey is FRCIBYDYVXQXGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClN2/c18-14-6-3-5-13(10-14)16-11-20-9-8-12-4-1-2-7-15(12)17(20)19-16/h1-11H.
What are the key properties of 2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline?
2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline has a molecular weight of 278.74 g/mol, XLogP of 4.81, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)imidazo[2,1-a]isoquinoline is sourced from PubChem (CID 13156067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).