3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide

C23H20FN3O2 — CID 53118530

IUPAC3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(NC(=O)CCc2c(-c3ccc(F)cc3)nc3ccccn23)cc1
InChIInChI=1S/C23H20FN3O2/c1-29-19-11-9-18(10-12-19)25-22(28)14-13-20-23(16-5-7-17(24)8-6-16)26-21-4-2-3-15-27(20)21/h2-12,15H,13-14H2,1H3,(H,25,28)
InChIKeySMKTWBSVFDDLLD-UHFFFAOYSA-N
MW389.43 g/mol
LogP4.72
Rot. Bonds6

About 3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide

3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide (PubChem CID 53118530) has the molecular formula C23H20FN3O2 and a molecular weight of 389.43 g/mol. Its IUPAC name is 3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound Name3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide
PubChem CID53118530
Molecular FormulaC23H20FN3O2
Molecular Weight389.43 g/mol
Exact Mass389.15
IUPAC Name3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(NC(=O)CCc2c(-c3ccc(F)cc3)nc3ccccn23)cc1
InChIInChI=1S/C23H20FN3O2/c1-29-19-11-9-18(10-12-19)25-22(28)14-13-20-23(16-5-7-17(24)8-6-16)26-21-4-2-3-15-27(20)21/h2-12,15H,13-14H2,1H3,(H,25,28)
InChIKeySMKTWBSVFDDLLD-UHFFFAOYSA-N
XLogP4.72
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.43
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide?
The IUPAC name of 3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide (CID 53118530) is 3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide.
What is the SMILES notation for 3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide?
The canonical SMILES for 3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide is COc1ccc(NC(=O)CCc2c(-c3ccc(F)cc3)nc3ccccn23)cc1.
What is the InChIKey of 3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide?
The InChIKey is SMKTWBSVFDDLLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20FN3O2/c1-29-19-11-9-18(10-12-19)25-22(28)14-13-20-23(16-5-7-17(24)8-6-16)26-21-4-2-3-15-27(20)21/h2-12,15H,13-14H2,1H3,(H,25,28).
What are the key properties of 3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide?
3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide has a molecular weight of 389.43 g/mol, XLogP of 4.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 53118530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).