6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine

C16H10BrN3 — CID 23025864

IUPAC6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine
SMILESBrc1cnc2nc(-c3ccc4ccccc4c3)[nH]c2c1
InChIInChI=1S/C16H10BrN3/c17-13-8-14-16(18-9-13)20-15(19-14)12-6-5-10-3-1-2-4-11(10)7-12/h1-9H,(H,18,19,20)
InChIKeyFMCHJRAOOGTHTN-UHFFFAOYSA-N
MW324.18 g/mol
LogP4.54
Rot. Bonds1

About 6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine

6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine (PubChem CID 23025864) has the molecular formula C16H10BrN3 and a molecular weight of 324.18 g/mol. Its IUPAC name is 6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine
PubChem CID23025864
Molecular FormulaC16H10BrN3
Molecular Weight324.18 g/mol
Exact Mass323.01
IUPAC Name6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine
SMILESBrc1cnc2nc(-c3ccc4ccccc4c3)[nH]c2c1
InChIInChI=1S/C16H10BrN3/c17-13-8-14-16(18-9-13)20-15(19-14)12-6-5-10-3-1-2-4-11(10)7-12/h1-9H,(H,18,19,20)
InChIKeyFMCHJRAOOGTHTN-UHFFFAOYSA-N
XLogP4.54
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.18
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine (CID 23025864) is 6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine is Brc1cnc2nc(-c3ccc4ccccc4c3)[nH]c2c1.
What is the InChIKey of 6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine?
The InChIKey is FMCHJRAOOGTHTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10BrN3/c17-13-8-14-16(18-9-13)20-15(19-14)12-6-5-10-3-1-2-4-11(10)7-12/h1-9H,(H,18,19,20).
What are the key properties of 6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine?
6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine has a molecular weight of 324.18 g/mol, XLogP of 4.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 23025864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).