cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone

C23H25FN4O — CID 129225891

IUPACcyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone
SMILESO=C(C1CCC1)N1CCN(Cc2c(-c3ccc(F)cc3)nc3ccccn23)CC1
InChIInChI=1S/C23H25FN4O/c24-19-9-7-17(8-10-19)22-20(28-11-2-1-6-21(28)25-22)16-26-12-14-27(15-13-26)23(29)18-4-3-5-18/h1-2,6-11,18H,3-5,12-16H2
InChIKeyGQBRGDGBYSJWSN-UHFFFAOYSA-N
MW392.48 g/mol
LogP3.58
Rot. Bonds4

About cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone

cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone (PubChem CID 129225891) has the molecular formula C23H25FN4O and a molecular weight of 392.48 g/mol. Its IUPAC name is cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone.

Molecular Properties

Compound Namecyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone
PubChem CID129225891
Molecular FormulaC23H25FN4O
Molecular Weight392.48 g/mol
Exact Mass392.20
IUPAC Namecyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone
SMILESO=C(C1CCC1)N1CCN(Cc2c(-c3ccc(F)cc3)nc3ccccn23)CC1
InChIInChI=1S/C23H25FN4O/c24-19-9-7-17(8-10-19)22-20(28-11-2-1-6-21(28)25-22)16-26-12-14-27(15-13-26)23(29)18-4-3-5-18/h1-2,6-11,18H,3-5,12-16H2
InChIKeyGQBRGDGBYSJWSN-UHFFFAOYSA-N
XLogP3.58
TPSA40.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone?
The IUPAC name of cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone (CID 129225891) is cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone.
What is the SMILES notation for cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone?
The canonical SMILES for cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone is O=C(C1CCC1)N1CCN(Cc2c(-c3ccc(F)cc3)nc3ccccn23)CC1.
What is the InChIKey of cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone?
The InChIKey is GQBRGDGBYSJWSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25FN4O/c24-19-9-7-17(8-10-19)22-20(28-11-2-1-6-21(28)25-22)16-26-12-14-27(15-13-26)23(29)18-4-3-5-18/h1-2,6-11,18H,3-5,12-16H2.
What are the key properties of cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone?
cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone has a molecular weight of 392.48 g/mol, XLogP of 3.58, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-[4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone is sourced from PubChem (CID 129225891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).