7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline

C15H9BrN4 — CID 57390736

IUPAC7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline
SMILESBrc1ccc2c(c1)ncc1[nH]c(-c3ccccn3)nc12
InChIInChI=1S/C15H9BrN4/c16-9-4-5-10-12(7-9)18-8-13-14(10)20-15(19-13)11-3-1-2-6-17-11/h1-8H,(H,19,20)
InChIKeyCEIOXLPLLHBZPB-UHFFFAOYSA-N
MW325.17 g/mol
LogP3.94
Rot. Bonds1

About 7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline

7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline (PubChem CID 57390736) has the molecular formula C15H9BrN4 and a molecular weight of 325.17 g/mol. Its IUPAC name is 7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline.

Molecular Properties

Compound Name7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline
PubChem CID57390736
Molecular FormulaC15H9BrN4
Molecular Weight325.17 g/mol
Exact Mass324.00
IUPAC Name7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline
SMILESBrc1ccc2c(c1)ncc1[nH]c(-c3ccccn3)nc12
InChIInChI=1S/C15H9BrN4/c16-9-4-5-10-12(7-9)18-8-13-14(10)20-15(19-13)11-3-1-2-6-17-11/h1-8H,(H,19,20)
InChIKeyCEIOXLPLLHBZPB-UHFFFAOYSA-N
XLogP3.94
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.17
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline?
The IUPAC name of 7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline (CID 57390736) is 7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline.
What is the SMILES notation for 7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline?
The canonical SMILES for 7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline is Brc1ccc2c(c1)ncc1[nH]c(-c3ccccn3)nc12.
What is the InChIKey of 7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline?
The InChIKey is CEIOXLPLLHBZPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9BrN4/c16-9-4-5-10-12(7-9)18-8-13-14(10)20-15(19-13)11-3-1-2-6-17-11/h1-8H,(H,19,20).
What are the key properties of 7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline?
7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline has a molecular weight of 325.17 g/mol, XLogP of 3.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2-pyridin-2-yl-3H-imidazo[4,5-c]quinoline is sourced from PubChem (CID 57390736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).