3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline

C23H20N4 — CID 70648788

IUPAC3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline
SMILESCc1cc2ncccc2c2nc(CCc3ccc4ccccc4n3)n(C)c12
InChIInChI=1S/C23H20N4/c1-15-14-20-18(7-5-13-24-20)22-23(15)27(2)21(26-22)12-11-17-10-9-16-6-3-4-8-19(16)25-17/h3-10,13-14H,11-12H2,1-2H3
InChIKeyORGFNMVJIGQYFH-UHFFFAOYSA-N
MW352.44 g/mol
LogP4.76
Rot. Bonds3

About 3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline

3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline (PubChem CID 70648788) has the molecular formula C23H20N4 and a molecular weight of 352.44 g/mol. Its IUPAC name is 3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline.

Molecular Properties

Compound Name3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline
PubChem CID70648788
Molecular FormulaC23H20N4
Molecular Weight352.44 g/mol
Exact Mass352.17
IUPAC Name3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline
SMILESCc1cc2ncccc2c2nc(CCc3ccc4ccccc4n3)n(C)c12
InChIInChI=1S/C23H20N4/c1-15-14-20-18(7-5-13-24-20)22-23(15)27(2)21(26-22)12-11-17-10-9-16-6-3-4-8-19(16)25-17/h3-10,13-14H,11-12H2,1-2H3
InChIKeyORGFNMVJIGQYFH-UHFFFAOYSA-N
XLogP4.76
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline?
The IUPAC name of 3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline (CID 70648788) is 3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline.
What is the SMILES notation for 3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline?
The canonical SMILES for 3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline is Cc1cc2ncccc2c2nc(CCc3ccc4ccccc4n3)n(C)c12.
What is the InChIKey of 3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline?
The InChIKey is ORGFNMVJIGQYFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4/c1-15-14-20-18(7-5-13-24-20)22-23(15)27(2)21(26-22)12-11-17-10-9-16-6-3-4-8-19(16)25-17/h3-10,13-14H,11-12H2,1-2H3.
What are the key properties of 3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline?
3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline has a molecular weight of 352.44 g/mol, XLogP of 4.76, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-2-(2-quinolin-2-ylethyl)imidazo[4,5-f]quinoline is sourced from PubChem (CID 70648788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).