2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine

C22H20FN3O2 — CID 59243052

IUPAC2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine
SMILESCC(C)Oc1cc(OCc2ccccc2F)cc(-c2nc3ccncc3[nH]2)c1
InChIInChI=1S/C22H20FN3O2/c1-14(2)28-18-10-16(22-25-20-7-8-24-12-21(20)26-22)9-17(11-18)27-13-15-5-3-4-6-19(15)23/h3-12,14H,13H2,1-2H3,(H,25,26)
InChIKeyUBRKSHWCAQXRQQ-UHFFFAOYSA-N
MW377.42 g/mol
LogP5.13
Rot. Bonds6

About 2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine

2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine (PubChem CID 59243052) has the molecular formula C22H20FN3O2 and a molecular weight of 377.42 g/mol. Its IUPAC name is 2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine
PubChem CID59243052
Molecular FormulaC22H20FN3O2
Molecular Weight377.42 g/mol
Exact Mass377.15
IUPAC Name2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine
SMILESCC(C)Oc1cc(OCc2ccccc2F)cc(-c2nc3ccncc3[nH]2)c1
InChIInChI=1S/C22H20FN3O2/c1-14(2)28-18-10-16(22-25-20-7-8-24-12-21(20)26-22)9-17(11-18)27-13-15-5-3-4-6-19(15)23/h3-12,14H,13H2,1-2H3,(H,25,26)
InChIKeyUBRKSHWCAQXRQQ-UHFFFAOYSA-N
XLogP5.13
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.42
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine?
The IUPAC name of 2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine (CID 59243052) is 2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine?
The canonical SMILES for 2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine is CC(C)Oc1cc(OCc2ccccc2F)cc(-c2nc3ccncc3[nH]2)c1.
What is the InChIKey of 2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine?
The InChIKey is UBRKSHWCAQXRQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FN3O2/c1-14(2)28-18-10-16(22-25-20-7-8-24-12-21(20)26-22)9-17(11-18)27-13-15-5-3-4-6-19(15)23/h3-12,14H,13H2,1-2H3,(H,25,26).
What are the key properties of 2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine?
2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine has a molecular weight of 377.42 g/mol, XLogP of 5.13, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 59243052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).