2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine

C20H16FN3 — CID 117165326

IUPAC2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine
SMILESCc1ccc(-n2c(Cc3ccccc3F)nc3cccnc32)cc1
InChIInChI=1S/C20H16FN3/c1-14-8-10-16(11-9-14)24-19(13-15-5-2-3-6-17(15)21)23-18-7-4-12-22-20(18)24/h2-12H,13H2,1H3
InChIKeyGRTMIDNGYSGUMO-UHFFFAOYSA-N
MW317.37 g/mol
LogP4.46
Rot. Bonds3

About 2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine

2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine (PubChem CID 117165326) has the molecular formula C20H16FN3 and a molecular weight of 317.37 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine
PubChem CID117165326
Molecular FormulaC20H16FN3
Molecular Weight317.37 g/mol
Exact Mass317.13
IUPAC Name2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine
SMILESCc1ccc(-n2c(Cc3ccccc3F)nc3cccnc32)cc1
InChIInChI=1S/C20H16FN3/c1-14-8-10-16(11-9-14)24-19(13-15-5-2-3-6-17(15)21)23-18-7-4-12-22-20(18)24/h2-12H,13H2,1H3
InChIKeyGRTMIDNGYSGUMO-UHFFFAOYSA-N
XLogP4.46
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.37
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine?
The IUPAC name of 2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine (CID 117165326) is 2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine?
The canonical SMILES for 2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine is Cc1ccc(-n2c(Cc3ccccc3F)nc3cccnc32)cc1.
What is the InChIKey of 2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine?
The InChIKey is GRTMIDNGYSGUMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN3/c1-14-8-10-16(11-9-14)24-19(13-15-5-2-3-6-17(15)21)23-18-7-4-12-22-20(18)24/h2-12H,13H2,1H3.
What are the key properties of 2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine?
2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine has a molecular weight of 317.37 g/mol, XLogP of 4.46, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 117165326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).