5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine

C19H14BrN3 — CID 10406442

IUPAC5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine
SMILESBrc1ccc(Cn2ccc3nc(-c4ccccc4)nc-3c2)cc1
InChIInChI=1S/C19H14BrN3/c20-16-8-6-14(7-9-16)12-23-11-10-17-18(13-23)22-19(21-17)15-4-2-1-3-5-15/h1-11,13H,12H2
InChIKeyBAONJJYITSLFLE-UHFFFAOYSA-N
MW364.25 g/mol
LogP4.86
Rot. Bonds3

About 5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine

5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine (PubChem CID 10406442) has the molecular formula C19H14BrN3 and a molecular weight of 364.25 g/mol. Its IUPAC name is 5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine
PubChem CID10406442
Molecular FormulaC19H14BrN3
Molecular Weight364.25 g/mol
Exact Mass363.04
IUPAC Name5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine
SMILESBrc1ccc(Cn2ccc3nc(-c4ccccc4)nc-3c2)cc1
InChIInChI=1S/C19H14BrN3/c20-16-8-6-14(7-9-16)12-23-11-10-17-18(13-23)22-19(21-17)15-4-2-1-3-5-15/h1-11,13H,12H2
InChIKeyBAONJJYITSLFLE-UHFFFAOYSA-N
XLogP4.86
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.25
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine?
The IUPAC name of 5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine (CID 10406442) is 5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine.
What is the SMILES notation for 5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine?
The canonical SMILES for 5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine is Brc1ccc(Cn2ccc3nc(-c4ccccc4)nc-3c2)cc1.
What is the InChIKey of 5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine?
The InChIKey is BAONJJYITSLFLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14BrN3/c20-16-8-6-14(7-9-16)12-23-11-10-17-18(13-23)22-19(21-17)15-4-2-1-3-5-15/h1-11,13H,12H2.
What are the key properties of 5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine?
5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine has a molecular weight of 364.25 g/mol, XLogP of 4.86, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-bromophenyl)methyl]-2-phenylimidazo[4,5-c]pyridine is sourced from PubChem (CID 10406442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).