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

C23H19ClFN3O2 — CID 3466001

IUPAC2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide
SMILESCC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1c(-c2ccc(F)cc2)nc2ccccn12
InChIInChI=1S/C23H19ClFN3O2/c1-23(2,30-18-12-8-16(24)9-13-18)22(29)27-21-20(15-6-10-17(25)11-7-15)26-19-5-3-4-14-28(19)21/h3-14H,1-2H3,(H,27,29)
InChIKeyJMEROYIEVHWRAR-UHFFFAOYSA-N
MW423.88 g/mol
LogP5.59
Rot. Bonds5

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

2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide (PubChem CID 3466001) has the molecular formula C23H19ClFN3O2 and a molecular weight of 423.88 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide
PubChem CID3466001
Molecular FormulaC23H19ClFN3O2
Molecular Weight423.88 g/mol
Exact Mass423.11
IUPAC Name2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide
SMILESCC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1c(-c2ccc(F)cc2)nc2ccccn12
InChIInChI=1S/C23H19ClFN3O2/c1-23(2,30-18-12-8-16(24)9-13-18)22(29)27-21-20(15-6-10-17(25)11-7-15)26-19-5-3-4-14-28(19)21/h3-14H,1-2H3,(H,27,29)
InChIKeyJMEROYIEVHWRAR-UHFFFAOYSA-N
XLogP5.59
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.88
LogP ≤ 55.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide (CID 3466001) is 2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide is CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1c(-c2ccc(F)cc2)nc2ccccn12.
What is the InChIKey of 2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide?
The InChIKey is JMEROYIEVHWRAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClFN3O2/c1-23(2,30-18-12-8-16(24)9-13-18)22(29)27-21-20(15-6-10-17(25)11-7-15)26-19-5-3-4-14-28(19)21/h3-14H,1-2H3,(H,27,29).
What are the key properties of 2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide?
2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide has a molecular weight of 423.88 g/mol, XLogP of 5.59, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide is sourced from PubChem (CID 3466001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).