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

C19H12Cl2FN3 — CID 58990500

IUPAC5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine
SMILESFc1ccccc1-c1nc2ccn(Cc3ccc(Cl)c(Cl)c3)cc-2n1
InChIInChI=1S/C19H12Cl2FN3/c20-14-6-5-12(9-15(14)21)10-25-8-7-17-18(11-25)24-19(23-17)13-3-1-2-4-16(13)22/h1-9,11H,10H2
InChIKeyMPIIAYNZASSSIO-UHFFFAOYSA-N
MW372.23 g/mol
LogP5.54
Rot. Bonds3

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

5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine (PubChem CID 58990500) has the molecular formula C19H12Cl2FN3 and a molecular weight of 372.23 g/mol. Its IUPAC name is 5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine
PubChem CID58990500
Molecular FormulaC19H12Cl2FN3
Molecular Weight372.23 g/mol
Exact Mass371.04
IUPAC Name5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine
SMILESFc1ccccc1-c1nc2ccn(Cc3ccc(Cl)c(Cl)c3)cc-2n1
InChIInChI=1S/C19H12Cl2FN3/c20-14-6-5-12(9-15(14)21)10-25-8-7-17-18(11-25)24-19(23-17)13-3-1-2-4-16(13)22/h1-9,11H,10H2
InChIKeyMPIIAYNZASSSIO-UHFFFAOYSA-N
XLogP5.54
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.23
LogP ≤ 55.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine?
The IUPAC name of 5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine (CID 58990500) is 5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine.
What is the SMILES notation for 5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine?
The canonical SMILES for 5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine is Fc1ccccc1-c1nc2ccn(Cc3ccc(Cl)c(Cl)c3)cc-2n1.
What is the InChIKey of 5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine?
The InChIKey is MPIIAYNZASSSIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12Cl2FN3/c20-14-6-5-12(9-15(14)21)10-25-8-7-17-18(11-25)24-19(23-17)13-3-1-2-4-16(13)22/h1-9,11H,10H2.
What are the key properties of 5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine?
5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine has a molecular weight of 372.23 g/mol, XLogP of 5.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3,4-dichlorophenyl)methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine is sourced from PubChem (CID 58990500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).