5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine

C19H13BrFN3 — CID 10045421

IUPAC5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine
SMILESFc1cccc(-c2nc3ccn(Cc4ccc(Br)cc4)cc-3n2)c1
InChIInChI=1S/C19H13BrFN3/c20-15-6-4-13(5-7-15)11-24-9-8-17-18(12-24)23-19(22-17)14-2-1-3-16(21)10-14/h1-10,12H,11H2
InChIKeyFOJZDDQQPWBVTG-UHFFFAOYSA-N
MW382.24 g/mol
LogP5.00
Rot. Bonds3

About 5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine

5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine (PubChem CID 10045421) has the molecular formula C19H13BrFN3 and a molecular weight of 382.24 g/mol. Its IUPAC name is 5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine
PubChem CID10045421
Molecular FormulaC19H13BrFN3
Molecular Weight382.24 g/mol
Exact Mass381.03
IUPAC Name5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine
SMILESFc1cccc(-c2nc3ccn(Cc4ccc(Br)cc4)cc-3n2)c1
InChIInChI=1S/C19H13BrFN3/c20-15-6-4-13(5-7-15)11-24-9-8-17-18(12-24)23-19(22-17)14-2-1-3-16(21)10-14/h1-10,12H,11H2
InChIKeyFOJZDDQQPWBVTG-UHFFFAOYSA-N
XLogP5.00
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.24
LogP ≤ 55.00
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-(3-fluorophenyl)imidazo[4,5-c]pyridine?
The IUPAC name of 5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine (CID 10045421) is 5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine.
What is the SMILES notation for 5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine?
The canonical SMILES for 5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine is Fc1cccc(-c2nc3ccn(Cc4ccc(Br)cc4)cc-3n2)c1.
What is the InChIKey of 5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine?
The InChIKey is FOJZDDQQPWBVTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13BrFN3/c20-15-6-4-13(5-7-15)11-24-9-8-17-18(12-24)23-19(22-17)14-2-1-3-16(21)10-14/h1-10,12H,11H2.
What are the key properties of 5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine?
5-[(4-bromophenyl)methyl]-2-(3-fluorophenyl)imidazo[4,5-c]pyridine has a molecular weight of 382.24 g/mol, XLogP of 5.00, 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-(3-fluorophenyl)imidazo[4,5-c]pyridine is sourced from PubChem (CID 10045421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).